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SMILES: COc1ccc(CNc2nc(nc3n(cnc23)C2CCCC2)N(CCO)CCO)cc1

InChI Key: InChIKey=OJWSEKLDYDUVFC-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50290618   
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))		BDBM50290618
PNG
(2-[[9-Cyclopentyl-6-(4-methoxy-benzylamino)-9H-pur...)
Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C2CCCC2)N(CCO)CCO)cc1
Show InChI InChI=1S/C22H30N6O3/c1-31-18-8-6-16(7-9-18)14-23-20-19-21(28(15-24-19)17-4-2-3-5-17)26-22(25-20)27(10-12-29)11-13-30/h6-9,15,17,29-30H,2-5,10-14H2,1H3,(H,23,25,26)
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PC cid
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Similars
Article
n/an/a 2.00E+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