3D structures mapped by conservation among orthologs

[ Domain: "Cyclin-like" // KOG0834 ]

 PyMOL session

[ Domain: "Cyclin-like" // Cyclin_N_1 ]

 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
CHEMBL3656868		IC50	=	0.00015	nM	458.97	N#CC1(CNc2nc(-c3cc(N[C@H]4CC[C@H](N)CC4)ncc3Cl)ccc2F)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656876		IC50	=	0.00016	nM	459.95	N#CC1(CNc2nc(-c3cc(N[C@H]4CC[C@H](O)CC4)ncc3Cl)ccc2F)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656866		IC50	=	0.00017	nM	517.05	COCCN[C@H]1CC[C@H](Nc2cc(-c3ccc(F)c(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656869		IC50	=	0.00017	nM	501.05	CCCN[C@H]1CC[C@H](Nc2cc(-c3ccc(F)c(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656867		IC50	=	0.00023	nM	531.08	COC[C@@H](C)N[C@H]1CC[C@H](Nc2cc(-c3ccc(F)c(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656877		IC50	=	0.00024	nM	441.96	N#CC1(CNc2cccc(-c3cc(N[C@H]4CC[C@H](O)CC4)ncc3Cl)n2)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656848		IC50	=	0.00026	nM	451.95	N[C@H]1CC[C@H](Nc2cc(-c3nc(NCC4CCOCC4)c(F)cc3F)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656865		IC50	=	0.00027	nM	545.06	CC1(N[C@H]2CC[C@H](Nc3cc(-c4ccc(F)c(NCC5(C#N)CCOCC5)n4)c(Cl)cn3)CC2)OCCO1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656878		IC50	=	0.00028	nM	469.03	CCN[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656843		IC50	=	0.0003	nM	447.99	CC1(CNc2nc(-c3cc(N[C@H]4CC[C@H](N)CC4)ncc3Cl)ccc2F)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656841		IC50	=	0.0003	nM	513.09	COC[C@@H](C)N[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656879		IC50	=	0.0003	nM	469.03	CN(C)[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656870		IC50	=	0.00031	nM	543.13	CCCN(CCC)[C@H]1CC[C@H](Nc2cc(-c3ccc(F)c(NCC4(C#N)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656880		IC50	=	0.00036	nM	553.03	N#CC1(CNc2cccc(-c3cc(N[C@H]4CC[C@H](NCCOC(F)(F)F)CC4)ncc3Cl)n2)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656881		IC50	=	0.00043	nM	525.1	N#CC1(CNc2cccc(-c3cc(N[C@H]4CC[C@H](NC5CCOCC5)CC4)ncc3Cl)n2)CCOCC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656856		IC50	=	0.00049	nM	540.11	CS(=O)(=O)CCN[C@H]1CC[C@H](Nc2cc(-c3ccc(F)c(NCC4CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656882		IC50	=	0.00063	nM	492.04	COCCN[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(F)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656883		IC50	=	0.0007	nM	550.17	COC[C@@H](C)N[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(C)CCS(=O)(=O)CC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656844		IC50	=	0.001	nM	433.96	N[C@H]1CC[C@H](Nc2cc(-c3cccc(NCC4(F)CCOCC4)n3)c(Cl)cn2)CC1	Homo sapiens	CHEMBL3705381	single protein format
CHEMBL3656817		IC50	=	0.001	nM	444.02	C[C@@H]1CC(CNc2cccc(-c3cc(N[C@H]4CC[C@H](N)CC4)ncc3Cl)n2)C[C@H](C)O1	Homo sapiens	CHEMBL3705381	single protein format