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SMILES: COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(C)CC(O)c2ccc(O)c(O)c2)cc1

InChI Key: InChIKey=SCUNRJOSBIFBHF-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50290607   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2


(Homo sapiens (Human))		BDBM50290607
PNG
(4-(1-Hydroxy-2-{[9-isopropyl-6-(4-methoxy-benzylam...)
Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(C)CC(O)c2ccc(O)c(O)c2)cc1
Show InChI InChI=1S/C25H30N6O4/c1-15(2)31-14-27-22-23(26-12-16-5-8-18(35-4)9-6-16)28-25(29-24(22)31)30(3)13-21(34)17-7-10-19(32)20(33)11-17/h5-11,14-15,21,32-34H,12-13H2,1-4H3,(H,26,28,29)
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PC cid
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Similars
Article
n/an/a 3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E

Bioorg Med Chem Lett 7: 2697-2702 (1997)


Article DOI: 10.1016/S0960-894X(97)10076-2
BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
More data for this
Ligand-Target Pair