3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

 PyMOL session

[ Domain: "Snake toxin-like" // Activin_recp ]

 PyMOL session

[ Alpha Fold Model ] (go)

Known binders annotated in ChEMBL

 IC50 CSV

Only the first 20 rows are shown.

molecule_chembl_id	structure	assay_type	relation	value	unit	mol_wt	smiles	organism	assay_chembl_id	bao_label
CHEMBL4792978		IC50	=	180.0	nM	310.4	Cc1ccc(-c2cnc(N)c(C(=O)NC3CCCCC3)n2)cc1	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4741913		IC50	=	190.0	nM	281.32	C=Cc1cn2ncc(-c3ccnc(OC)c3)c2nc1NC	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4752199		IC50	=	310.0	nM	285.31	CNc1nc2c(-c3ccnc(OC)c3)cnn2cc1OC	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4749011		IC50	=	530.0	nM	336.36	COc1cc(-c2cnn3cc(OC)c(-c4cnn(C)c4)nc23)ccn1	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4744988		IC50	=	630.0	nM	295.35	CNc1nc2c(-c3ccnc(OC)c3)cnn2cc1C1CC1	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4741185		IC50	=	700.0	nM	283.34	CCc1cn2ncc(-c3ccnc(OC)c3)c2nc1NC	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4747422		IC50	=	800.0	nM	378.44	COc1cn2ncc(-c3ccnc(OC(C)(C)C)c3)c2nc1-c1cnn(C)c1	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL4744618		IC50	=	860.0	nM	362.39	COc1cn2ncc(-c3ccnc(OC4CC4)c3)c2nc1-c1cnn(C)c1	Homo sapiens	CHEMBL4714985	single protein format
CHEMBL5417444		IC50	=	860.0	nM	453.45	COc1cc(-n2cnc3cc(-c4cnn(C)c4)ccc32)cc(OC(F)F)c1C(=O)NC1CC1	Homo sapiens	CHEMBL5345793	single protein format
CHEMBL4763122		IC50	=	960.0	nM	284.32	CCc1nc2c(-c3ccnc(OC)c3)cnn2cc1OC	Homo sapiens	CHEMBL4714985	single protein format