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SMILES: COc1ccc(CNc2nc(NC3CCCCC3O)nc3n(cnc23)C(C)C)cc1

InChI Key: InChIKey=XSZUUWVULVZGON-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50290600   
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))		BDBM50290600
PNG
(2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...)
Show SMILES COc1ccc(CNc2nc(NC3CCCCC3O)nc3n(cnc23)C(C)C)cc1
Show InChI InChI=1S/C22H30N6O2/c1-14(2)28-13-24-19-20(23-12-15-8-10-16(30-3)11-9-15)26-22(27-21(19)28)25-17-6-4-5-7-18(17)29/h8-11,13-14,17-18,29H,4-7,12H2,1-3H3,(H2,23,25,26,27)
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PC cid
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Similars
Article
n/an/a 1.00E+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