Human curated protein

A0A075B6I6

Probable non-functional immunoglobulin lambda variable 1-50

Gene: IGLV1-50 Organism: Homo sapiens Reviewed UniProt

All human targets

Length 118 aa

Mass 12,339 Da

Annotation score 3/5

Entry version 55

Ligand records 134

Overview

Probable non-functional open reading frame (ORF) of V region of the variable domain of immunoglobulin light chains (PubMed:24600447).

Most probably a non-functional protein that cannot participate in the synthesis of a productive immunoglobulin chain due to an unusual recombination signal (RS) sequence altering V-(D)-J recombination (PubMed:9619395)

Subunit structure

Immunoglobulins are composed of two identical heavy chains and two identical light chains; disulfide-linked

Polymorphism

There are several alleles. The sequence shown is that of IMGT allele IGLV1-50*01

Publications

Identifiers

Gene: IGLV1-50
UniProt: A0A075B6I6
Organism: Homo sapiens (taxon 9606)

Eukaryota › Metazoa › Chordata › Craniata › Vertebrata › Euteleostomi › Mammalia › Eutheria › Euarchontoglires › Primates › Haplorrhini › Catarrhini › Hominidae › Homo

Subcellular location

Secreted Cell membrane

Keywords

Adaptive immunity Cell membrane Disulfide bond Immunity Immunoglobulin Immunoglobulin domain Membrane Proteomics identification Reference proteome Secreted Signal

Function

Molecular function, catalytic activity, and Gene Ontology annotations.

0 EC 5 GO

Probable non-functional open reading frame (ORF) of V region of the variable domain of immunoglobulin light chains (PubMed:24600447). Non-functional ORF generally cannot participate in the synthesis of a productive immunoglobulin chain due to altered V-(D)-J or switch recombination and/or splicing site (at mRNA level) and/or conserved amino acid change (protein level) (PubMed:9619395). Immunoglobulins, also known as antibodies, are membrane-bound or secreted glycoproteins produced by B lymphocytes. In the recognition phase of humoral immunity, the membrane-bound immunoglobulins serve as receptors which, upon binding of a specific antigen, trigger the clonal expansion and differentiation of B lymphocytes into immunoglobulins-secreting plasma cells. Secreted immunoglobulins mediate the effector phase of humoral immunity, which results in the elimination of bound antigens (PubMed:20176268, PubMed:22158414). The antigen binding site is formed by the variable domain of one heavy chain, together with that of its associated light chain. Thus, each immunoglobulin has two antigen binding sites with remarkable affinity for a particular antigen. The variable domains are assembled by a process called V-(D)-J rearrangement and can then be subjected to somatic hypermutations which, after exposure to antigen and selection, allow affinity maturation for a particular antigen (PubMed:17576170, PubMed:20176268)

Biological process

adaptive immune response immune response

Cellular component

extracellular region immunoglobulin complex plasma membrane

Sequence

118 amino acids

MAWSSLLLTLLAHCTGSWAQSVLTQPPSVSGAPGQRVTISCTGSSSNIGAGYVVHWYQQLPGTAPKLLIYGNSNRPSGVPDQFSGSKSGTSASLAITGLQSEDEADYYCKAWDNSLNA

Signal

1–19 —

Chain

20–118 Probable non-functional immunoglobulin lambda variable 1-50

Domain

20–118 Ig-like

Region

20–44 Framework-1

45–53 Complementarity-determining-1

54–70 Framework-2

71–73 Complementarity-determining-2

74–109 Framework-3

110–118 Complementarity-determining-3

Disulfide bond

41–109 —

Ligand evidence

Ligands grouped by evidence source, via the same LigQ_2 pipeline used across Target.

134 records

Chemistry signal

Structural and bioactivity evidence are both available for this target.

Direct evidence 0 same-protein records

Transferred evidence 84 records from similar proteins

Structural ligands 55 0 loaded crystals

Measured bioactivity 29 direct and transferred ChEMBL records

Proposed compounds 50 similarity-based ZINC candidates

No co-crystallized ligand found for this exact protein.

Ligand	Source crystal	UniProt (homolog)	MW · LogP · TPSA	Lipinski	PAINS	SMILES
15P RCSB PDB	4UNU	P01709	1529.8 Da LogP 0.17 TPSA 334.1	2 viol.	✓ Clean	`COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO…`
2M9 RCSB PDB	4NJA	P01660	472.5 Da LogP 2.33 TPSA 172.3	✓ Ro5	✓ Clean	`COc1cc(c2ccc3c(cc(c4c3c2c1cc4)S(=O)(=O)O)S(=O)(…`
33O RCSB PDB	4TPR	A2NHM3	590.7 Da LogP -0.83 TPSA 151.2	2 viol.	✓ Clean	`C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O`
88Q RCSB PDB	4AIZ	Q5NV90	262.3 Da LogP -1.21 TPSA 99.4	✓ Ro5	✓ Clean	`C1C[C@@](CO[C@@H]1[C@@H]2CC[C@@](CO2)(CO)O)(CO)O`
ACM RCSB PDB	2IPU	A2NHM3	59.1 Da LogP -0.51 TPSA 43.1	✓ Ro5	✓ Clean	`CC(=O)N`
AN1 RCSB PDB	1LO3	Q65ZC0	264.3 Da LogP 4.32 TPSA 37.3	✓ Ro5	✓ Clean	`Cc1c2ccccc2c(c3c1cccc3)CCC(=O)O`
ANF RCSB PDB	2BJM	P01724	194.2 Da LogP 3.70 TPSA 20.2	✓ Ro5	✓ Clean	`c1ccc2c(c1)cc3ccccc3c2O`
ANO RCSB PDB	2O5Z	P01631	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C…`
ANQ RCSB PDB	1OAX	P01724	182.2 Da LogP 2.22 TPSA 34.1	✓ Ro5	Alert	`c1cc2cccc3c2c(c1)C(=O)C3=O`
AZI RCSB PDB	2VQ1	P01631	42.0 Da LogP 0.87 TPSA 58.7	✓ Ro5	Alert	`[N-]=[N+]=[N-]`
AZN RCSB PDB	1OAR	P01724	320.3 Da LogP 1.12 TPSA 129.0	✓ Ro5	Alert	`c1ccc2c(c1)C(=O)c3cc(c(c(c3C2=O)O)O)S(=O)(=O)O`
B3P RCSB PDB	3CFK	Q8TCD0	282.3 Da LogP -4.01 TPSA 145.4	1 viol.	✓ Clean	`C(CNC(CO)(CO)CO)CNC(CO)(CO)CO`
BEZ RCSB PDB	1NCW	Q58EU8	122.1 Da LogP 1.38 TPSA 37.3	✓ Ro5	✓ Clean	`c1ccc(cc1)C(=O)O`
CAC RCSB PDB	1OAR	P01724	137.0 Da LogP -0.52 TPSA 40.1	✓ Ro5	✓ Clean	`C[As](=O)(C)[O-]`
CPD RCSB PDB	2DQT	A2NHM3	743.5 Da LogP 4.81 TPSA 183.4	1 viol.	✓ Clean	`CCNC(=O)N(CCCN(C)C)[P@](=O)(Cc1ccc(cc1)NC(=O)C(…`
DNS RCSB PDB	1WZ1	P01631	379.5 Da LogP 1.77 TPSA 112.7	✓ Ro5	✓ Clean	`CN(C)c1cccc2c1cccc2S(=O)(=O)NCCCC[C@@H](C(=O)O)N`
DP4 RCSB PDB	1ND0	Q58EU8	249.4 Da LogP 2.71 TPSA 23.1	✓ Ro5	✓ Clean	`C[N+]1(CCC(CC1)[Si](C)(C)c2ccccc2)[O-]`
E3G RCSB PDB	1CFV	P01631	446.5 Da LogP 1.38 TPSA 133.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CCC2=O)…`
EST RCSB PDB	1JGL	Q7TS98	272.4 Da LogP 3.61 TPSA 40.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H…`
ETX RCSB PDB	2FD6	Q52L64	90.1 Da LogP 0.02 TPSA 29.5	✓ Ro5	✓ Clean	`CCOCCO`
FLC RCSB PDB	4Y5X	Q5NV67	189.1 Da LogP -5.25 TPSA 140.6	✓ Ro5	✓ Clean	`C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O`
FLU RCSB PDB	1T66	Q65ZC0	332.3 Da LogP 3.97 TPSA 87.7	✓ Ro5	✓ Clean	`c1ccc(c(c1)C2=C3C=CC(=O)C=C3Oc4c2ccc(c4)O)C(=O)O`
FUR RCSB PDB	1OAY	P01724	223.1 Da LogP 0.82 TPSA 103.8	✓ Ro5	✓ Clean	`c1cc(oc1C=NN2C=COC2=O)[N+](=O)[O-]`
GAS RCSB PDB	2CGR	A2P1G9	384.4 Da LogP 3.79 TPSA 97.5	✓ Ro5	✓ Clean	`c1ccc(cc1)C(c2ccccc2)NC(=NCC(=O)O)Nc3ccc(cc3)C#N`
GAS RCSB PDB	1ETZ	G0YP42	384.4 Da LogP 3.79 TPSA 97.5	✓ Ro5	✓ Clean	`c1ccc(cc1)C(c2ccccc2)NC(=NCC(=O)O)Nc3ccc(cc3)C#N`
HBC RCSB PDB	1JGU	Q52L64	291.4 Da LogP 3.78 TPSA 43.1	✓ Ro5	✓ Clean	`c1ccc(cc1)[C@@H]2[C@H]3CC[C@H](C3)[C@@]2(C(=O)c…`
HOP RCSB PDB	1AXS	Q7Z3Y4	381.5 Da LogP 3.69 TPSA 86.6	✓ Ro5	✓ Clean	`c1ccc(cc1)[C@H]2CC[C@@H]([C@H](C2)O)c3ccc(cc3)C…`
IUM RCSB PDB	1EFQ	P06312	270.0 Da LogP -2.38 TPSA 46.1	✓ Ro5	✓ Clean	`[O-][U+4][O-]`
LDA RCSB PDB	3EHB	P01636	229.4 Da LogP 4.48 TPSA 23.1	✓ Ro5	✓ Clean	`CCCCCCCCCCCC[N+](C)(C)[O-]`
LMT RCSB PDB	3EHB	P01636	510.6 Da LogP -0.45 TPSA 178.5	3 viol.	✓ Clean	`CCCCCCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1…`
MBT RCSB PDB	5ACM	P01709	284.4 Da LogP 3.86 TPSA 19.4	✓ Ro5	✓ Clean	`CN(C)c1ccc2c(c1)[s+]c3cc(ccc3n2)N(C)C`
MOI RCSB PDB	1Q0Y	P01724	285.3 Da LogP 1.20 TPSA 52.9	✓ Ro5	✓ Clean	`C[N@]1CC[C@]23c4c5ccc(c4O[C@H]2[C@H](C=C[C@H]3[…`
MT1 RCSB PDB	4OCX	A2NHM3	455.5 Da LogP -0.31 TPSA 211.8	✓ Ro5	✓ Clean	`CN(Cc1cnc2c(n1)c(nc([nH+]2)N)N)c3ccc(cc3)C(=O)N…`
NCH RCSB PDB	1DL7	P01724	305.2 Da LogP 1.80 TPSA 98.9	✓ Ro5	✓ Clean	`C[N+](C)(C)CCO[P@](=O)(O)Oc1ccc(cc1)[N+](=O)[O-]`
NDG RCSB PDB	2FD6	Q52L64	221.2 Da LogP -3.08 TPSA 119.3	✓ Ro5	✓ Clean	`CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O)CO)O…`
NES RCSB PDB	1YNL	A2P1G9	229.3 Da LogP -2.82 TPSA 127.1	✓ Ro5	✓ Clean	`C(CS(=O)(=O)O)NC(CO)(CO)CO`
NIP RCSB PDB	1A6W	P01724	435.2 Da LogP 0.87 TPSA 132.6	✓ Ro5	✓ Clean	`c1c(cc(c(c1[N+](=O)[O-])O)I)CC(=O)NCCCCCC(=O)[O…`
NPA RCSB PDB	1NGP	G0YP42	197.1 Da LogP 0.93 TPSA 100.7	✓ Ro5	✓ Clean	`c1cc(c(cc1CC(=O)O)[N+](=O)[O-])O`
NPO RCSB PDB	1YEK	Q58EU8	139.1 Da LogP 1.30 TPSA 63.4	✓ Ro5	✓ Clean	`c1cc(ccc1[N+](=O)[O-])O`
OX1 RCSB PDB	1LO2	Q65ZC0	296.3 Da LogP 3.33 TPSA 55.8	✓ Ro5	✓ Clean	`CC12c3ccccc3C(c4c1cccc4)(OO2)CCC(=O)O`
PDE RCSB PDB	1KN4	Q58EU8	360.3 Da LogP 1.53 TPSA 156.1	✓ Ro5	✓ Clean	`C[C@@H](C(=O)O)NC(=O)CCC[P@@](=O)(O)Oc1ccc(cc1)…`
PEO RCSB PDB	3HB3	P01636	34.0 Da LogP 0.02 TPSA 40.5	✓ Ro5	✓ Clean	`OO`
PER RCSB PDB	3EHB	P01636	32.0 Da LogP -2.38 TPSA 46.1	✓ Ro5	✓ Clean	`[O-][O-]`
PGG RCSB PDB	1YEI	Q58EU8	346.2 Da LogP 1.14 TPSA 156.1	✓ Ro5	✓ Clean	`c1cc(ccc1[N+](=O)[O-])O[P@@](=O)(CCCC(=O)NCC(=O…`
PME RCSB PDB	1A8J	P01709	294.3 Da LogP -0.31 TPSA 118.7	✓ Ro5	✓ Clean	`COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)N`
PNE RCSB PDB	1KN2	Q58EU8	360.3 Da LogP 1.53 TPSA 156.1	✓ Ro5	✓ Clean	`CC(C(=O)O)NC(=O)CCC[P@@](=O)(O)Oc1ccc(cc1)[N+](…`
PNF RCSB PDB	1YEJ	Q58EU8	402.3 Da LogP 2.70 TPSA 156.1	✓ Ro5	✓ Clean	`c1cc(ccc1[N+](=O)[O-])O[P@@](=O)(CCCC(=O)NCCCCC…`
RBF RCSB PDB	2FL5	Q5FWF9	376.4 Da LogP -1.72 TPSA 161.6	✓ Ro5	✓ Clean	`Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@…`
SAS RCSB PDB	5ACL	P01709	398.4 Da LogP 3.70 TPSA 141.3	✓ Ro5	Alert	`c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)/N=N/c3ccc(c(c3)C…`
SC5 RCSB PDB	1YNK	A2P1G9	330.4 Da LogP 1.09 TPSA 102.6	1 viol.	✓ Clean	`C[C@H](c1ccccc1)NC(NCC(O)O)Nc2ccc(cc2)CN`
STG RCSB PDB	1BFV	P01631	464.5 Da LogP 0.15 TPSA 156.9	1 viol.	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1C[C@H](…`
STR RCSB PDB	2O5Y	P01631	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=…`
TES RCSB PDB	1I9J	Q65ZC0	288.4 Da LogP 3.88 TPSA 37.3	✓ Ro5	✓ Clean	`C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(…`
TMO RCSB PDB	4OB5	P01619	75.1 Da LogP 0.19 TPSA 23.1	✓ Ro5	✓ Clean	`C[N+](C)(C)[O-]`
TPM RCSB PDB	1F3D	A2NHM3	204.3 Da LogP 0.02 TPSA 52.0	✓ Ro5	Alert	`c1cc(ccc1CNC2=[NH+]CCCC2)N`

No matches.

Ligand	UniProt (homolog)	pchembl	MW · LogP · TPSA	Lipinski	PAINS	SMILES
CHEMBL4866500 ChEMBL	P01721	8.41 ~3.9 nM	592.7 Da LogP 4.93 TPSA 105.2	1 viol.	✓ Clean	`Cc1c(CCN2CC3(CCN(c4nccn5ccnc45)CC3)NC2=O)c(=O)o…`
CHEMBL4874211 ChEMBL	P01721	8.39 ~4.1 nM	578.7 Da LogP 4.89 TPSA 105.2	1 viol.	✓ Clean	`Cc1c(CCN2CC3(CCN(c4nccn5ccnc45)CC3)NC2=O)c(=O)o…`
CHEMBL4870683 ChEMBL	P01721	8.33 ~4.7 nM	530.6 Da LogP 3.22 TPSA 123.5	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3CC4(CCN(c5ncnc6[nH]ncc56…`
CHEMBL4848583 ChEMBL	P01721	8.31 ~4.9 nM	529.6 Da LogP 3.60 TPSA 99.2	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3CC4(CCN(c5nccn6ccnc56)CC…`
CHEMBL4856046 ChEMBL	P01721	8.26 ~5.5 nM	578.7 Da LogP 4.89 TPSA 105.2	1 viol.	✓ Clean	`Cc1c(CCN2CC3(CCN(c4nccn5ccnc45)CC3)NC2=O)c(=O)o…`
CHEMBL4859730 ChEMBL	P01721	7.87 ~13.5 nM	490.6 Da LogP 3.34 TPSA 94.8	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3CC4(CCN(c5ncccn5)CC4)NC3…`
CHEMBL4849658 ChEMBL	P01721	7.58 ~26.3 nM	501.6 Da LogP 4.77 TPSA 104.6	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cccc(-c4ccc[nH]c…`
CHEMBL4855805 ChEMBL	P01721	7.55 ~28.2 nM	474.6 Da LogP 4.81 TPSA 100.5	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cccc(-c4c[nH]cn4…`
CHEMBL4866739 ChEMBL	P01721	7.53 ~29.5 nM	543.6 Da LogP 3.12 TPSA 116.3	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5nccn6ccnc…`
CHEMBL4856361 ChEMBL	P01721	7.34 ~45.7 nM	544.6 Da LogP 2.75 TPSA 140.6	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5ncnc6[nH]…`
CHEMBL4854105 ChEMBL	P01721	7.26 ~55.0 nM	544.6 Da LogP 2.52 TPSA 129.2	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5nccn6ncnc…`
CHEMBL4862037 ChEMBL	P01721	6.99 ~102.3 nM	544.6 Da LogP 2.75 TPSA 140.6	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5ncnc6[nH]…`
CHEMBL4848404 ChEMBL	P01721	6.84 ~144.5 nM	578.7 Da LogP 4.89 TPSA 105.2	1 viol.	✓ Clean	`Cc1c(CN2CC3(CCN(c4nccn5ccnc45)CC3)NC2=O)c(=O)oc…`
CHEMBL4858385 ChEMBL	P01721	6.82 ~151.4 nM	451.5 Da LogP 3.52 TPSA 114.9	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cccc(C(N)=O)c3)c…`
CHEMBL4850480 ChEMBL	P01721	6.78 ~166.0 nM	504.6 Da LogP 2.87 TPSA 111.9	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5ncccn5)CC…`
CHEMBL4872061 ChEMBL	P01721	6.71 ~195.0 nM	465.6 Da LogP 4.37 TPSA 100.9	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cccc(NC(C)=O)c3)…`
CHEMBL4846353 ChEMBL	P01721	6.68 ~208.9 nM	552.7 Da LogP 2.88 TPSA 120.2	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(S(=O)(=O)c5…`
CHEMBL4855362 ChEMBL	P01721	6.52 ~302.0 nM	408.5 Da LogP 4.42 TPSA 71.8	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3ccccc3)c(=O)oc2c1`
CHEMBL4871026 ChEMBL	P01721	6.50 ~316.2 nM	553.6 Da LogP 2.27 TPSA 133.1	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(S(=O)(=O)c5…`
CHEMBL4859449 ChEMBL	P01721	6.45 ~354.8 nM	530.6 Da LogP 2.36 TPSA 140.6	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5ncnc6[nH]…`
CHEMBL4867929 ChEMBL	P01721	6.38 ~416.9 nM	409.5 Da LogP 3.81 TPSA 84.7	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cccnc3)c(=O)oc2c1`
CHEMBL4875945 ChEMBL	P01721	6.35 ~446.7 nM	294.4 Da LogP 4.28 TPSA 39.4	✓ Ro5	✓ Clean	`Cc1cc(=O)oc2cc(OCC(C)c3ccccc3)ccc12`
CHEMBL4861156 ChEMBL	P01721	6.16 ~691.8 nM	490.6 Da LogP 2.48 TPSA 111.9	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(c5ncccn5)C4…`
CHEMBL4871041 ChEMBL	P01721	6.14 ~724.4 nM	506.6 Da LogP 2.05 TPSA 131.9	1 viol.	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCN3C(=O)NC4(CCN(C(=O)c5c[nH…`
CHEMBL4877002 ChEMBL	P01721	6.09 ~812.8 nM	466.5 Da LogP 3.77 TPSA 113.8	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(C)c(CCOC(=O)NCc3cncc(NC(C)=O)c3)…`
6ZW ChEMBL	P01721	—	231.3 Da LogP 2.95 TPSA 33.5	✓ Ro5	✓ Clean	`CCN(CC)c1ccc2c(c1)OC(=O)C=C2C`
CHEMBL4751505 ChEMBL	P01721	—	357.3 Da LogP 2.61 TPSA 78.5	✓ Ro5	✓ Clean	`CC(C)C[C@H]1NC(=O)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)C…`
CHEMBL4755143 ChEMBL	P01721	—	357.3 Da LogP 2.61 TPSA 78.5	✓ Ro5	✓ Clean	`CC(C)C[C@@H]1NC(=O)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)…`
CHEMBL4787077 ChEMBL	P01721	—	383.4 Da LogP 3.14 TPSA 78.5	✓ Ro5	✓ Clean	`CC1CCCCC12NC(=O)N(CC(=O)Nc1ccc(C(F)(F)F)cc1)C2=O`

Ligand	Tanimoto	MW · LogP · TPSA	Lipinski	PAINS	SMILES
ZINC100053689 ZINC	1.000	482.6 Da LogP -1.23 TPSA 178.5	2 viol.	✓ Clean	`CCCCCCCCCCO[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H]…`
ZINC102136963 ZINC	1.000	464.5 Da LogP 0.15 TPSA 156.9	1 viol.	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC102136971 ZINC	1.000	464.5 Da LogP 0.15 TPSA 156.9	1 viol.	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC12501520 ZINC	1.000	458.5 Da LogP -0.88 TPSA 123.5	1 viol.	✓ Clean	`OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO`
ZINC13521486 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(…`
ZINC13542968 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@]4(…`
ZINC13547862 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(…`
ZINC146808928 ZINC	1.000	446.5 Da LogP 1.38 TPSA 133.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC1530141 ZINC	1.000	229.3 Da LogP -2.82 TPSA 127.1	✓ Ro5	✓ Clean	`O=S(=O)(O)CCNC(CO)(CO)CO`
ZINC1683141 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(…`
ZINC16890045 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@H](CC[C@H]4CC(=O)CC[C@@]43C)…`
ZINC173985 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@@]43…`
ZINC2039372 ZINC	1.000	229.4 Da LogP 4.48 TPSA 23.1	✓ Ro5	✓ Clean	`CCCCCCCCCCCC[N+](C)(C)[O-]`
ZINC2053493146 ZINC	1.000	482.6 Da LogP -1.23 TPSA 178.5	2 viol.	✓ Clean	`CCCCCCCCCCO[C@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H]…`
ZINC2159863 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4…`
ZINC238924247 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C…`
ZINC242648889 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(…`
ZINC253498271 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@H]1CC[C@H]1[C@H]2CC[C@@]2(C)C…`
ZINC253617314 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@]43C…`
ZINC2545087 ZINC	1.000	379.5 Da LogP 1.77 TPSA 112.7	✓ Ro5	✓ Clean	`CN(C)c1cccc2c(S(=O)(=O)NCCCC[C@H](N)C(=O)O)cccc…`
ZINC3132721 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C…`
ZINC3844007 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(…`
ZINC3874716 ZINC	1.000	414.5 Da LogP -0.90 TPSA 114.3	✓ Ro5	✓ Clean	`OCCOCCOCCOCCOCCOCCOCCOCCOCCO`
ZINC3874744 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4…`
ZINC3881403 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@@]43C)…`
ZINC394228 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@@H](CC[C@H]4CC(=O)CC[C@@]43C…`
ZINC40165219 ZINC	1.000	464.5 Da LogP 0.15 TPSA 156.9	1 viol.	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC4081602 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C…`
ZINC4081603 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(…`
ZINC4081985 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C…`
ZINC4081988 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@@H](CC[C@H]4CC(=O)CC[C@@]43C…`
ZINC4096200 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CC(=O)CC[C@]34C)…`
ZINC4099004 ZINC	1.000	446.5 Da LogP 1.38 TPSA 133.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC4175375 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@H](CC[C@H]4CC(=O)CC[C@@]43C)…`
ZINC4283769 ZINC	1.000	238.3 Da LogP -0.96 TPSA 77.4	✓ Ro5	✓ Clean	`OCCOCCOCCOCCOCCO`
ZINC4428529 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C…`
ZINC4521548 ZINC	1.000	282.3 Da LogP -0.95 TPSA 86.6	✓ Ro5	✓ Clean	`OCCOCCOCCOCCOCCOCCO`
ZINC514252357 ZINC	1.000	446.5 Da LogP 1.38 TPSA 133.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC514252358 ZINC	1.000	446.5 Da LogP 1.38 TPSA 133.5	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC5178829 ZINC	1.000	326.4 Da LogP -0.93 TPSA 95.8	✓ Ro5	✓ Clean	`OCCOCCOCCOCCOCCOCCOCCO`
ZINC5178830 ZINC	1.000	370.4 Da LogP -0.91 TPSA 105.1	✓ Ro5	✓ Clean	`OCCOCCOCCOCCOCCOCCOCCOCCO`
ZINC519267 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@H](CC[C@@H]4CC(=O)CC[C@]43C)…`
ZINC5260762 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4…`
ZINC58508851 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CCC(=O)C[C@@H]1CC[C@H]1[C@H]2CC[C@@]2(C)…`
ZINC675050365 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C…`
ZINC70669940 ZINC	1.000	482.6 Da LogP -1.23 TPSA 178.5	2 viol.	✓ Clean	`CCCCCCCCCCO[C@@H]1O[C@@H](CO)[C@@H](O[C@H]2O[C@…`
ZINC8234405 ZINC	1.000	464.5 Da LogP 0.15 TPSA 156.9	1 viol.	✓ Clean	`C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@…`
ZINC8580672 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(…`
ZINC9212411 ZINC	1.000	314.5 Da LogP 4.72 TPSA 34.1	✓ Ro5	✓ Clean	`CC(=O)[C@H]1CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)…`
ZINC9212438 ZINC	1.000	288.4 Da LogP 4.17 TPSA 34.1	✓ Ro5	✓ Clean	`C[C@]12CC[C@@H]3[C@H](CC[C@@H]4CC(=O)CC[C@@]43C…`

Cross-references

External database identifiers grouped by category.

Structure

AlphaFoldDBA0A075B6I6
EMDBEMD-12570
EMDBEMD-44276
EMDBEMD-4452
EMDBEMD-9649
EMDBEMD-9650
EMDBEMD-9651
SMRA0A075B6I6

Family & domains

Gene3D2.60.40.10
InterProIPR007110
InterProIPR036179
InterProIPR013783
InterProIPR003599
InterProIPR013106
InterProIPR050150
PANTHERPTHR23267
PfamPF07686
SMARTSM00409
SMARTSM00406
SUPFAMSSF48726
PROSITEPS50835

Sequence

EMBLAC245060

Genome annotation

EnsemblENST00000390291.2
UCSCuc062cbn.1

Organism databases

GeneCardsIGLV1-50
HGNCHGNC:5881

Expression

BgeeENSG00000211645

Phylogenomics

GeneTreeENSGT00940000154293
HOGENOMCLU_077975_4_0_1
InParanoidA0A075B6I6
OMAEYYCATW
OrthoDB9838202at2759
PhylomeDBA0A075B6I6

Proteomic

MassIVEA0A075B6I6

Other

FunCoupA0A075B6I6
BioMutaIGLV1-50
AGRHGNC:5881
HPAENSG00000211645
VEuPathDBHostDB:ENSG00000211645
PAN-GOA0A075B6I6
SignaLinkA0A075B6I6
AgoraENSG00000211645
PROPR:A0A075B6I6
ProteomesUP000005640
RNActA0A075B6I6
GOGO:0005576
GOGO:0019814
GOGO:0005886
GOGO:0002250
GOGO:0006955
FunFam2.60.40.10:FF:000442