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SMILES: COc1ccc(CNc2nc(NC(C)(O)CO)nc3n(cnc23)C(C)C)cc1

InChI Key: InChIKey=LASSXLIBWVEMIH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50290586   
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))		BDBM50290586
PNG
(2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...)
Show SMILES COc1ccc(CNc2nc(NC(C)(O)CO)nc3n(cnc23)C(C)C)cc1
Show InChI InChI=1S/C19H26N6O3/c1-12(2)25-11-21-15-16(20-9-13-5-7-14(28-4)8-6-13)22-18(23-17(15)25)24-19(3,27)10-26/h5-8,11-12,26-27H,9-10H2,1-4H3,(H2,20,22,23,24)
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Similars
Article
n/an/a 500n/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