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SMILES: CC(C)n1cnc2c(NCc3ccc4OCOc4c3)nc(nc12)N(CCO)CCO

InChI Key: InChIKey=PNXVUJVQINHRQA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50290623   
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))		BDBM50290623
PNG
(2-[{6-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-9-isop...)
Show SMILES CC(C)n1cnc2c(NCc3ccc4OCOc4c3)nc(nc12)N(CCO)CCO
Show InChI InChI=1S/C20H26N6O4/c1-13(2)26-11-22-17-18(21-10-14-3-4-15-16(9-14)30-12-29-15)23-20(24-19(17)26)25(5-7-27)6-8-28/h3-4,9,11,13,27-28H,5-8,10,12H2,1-2H3,(H,21,23,24)
PDB

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PC cid
PC sid
UniChem

Similars
Article
n/an/a 800n/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