BDBM50027402 CHEMBL1744451

SMILES: CN1CCC(CC1)C(=O)N1Cc2c(NC(=O)c3ccncc3)n[nH]c2C1(C)C

InChI Key: InChIKey=GQDHKYZSKSDSNQ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50027402   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50027402 (CHEMBL1744451) Show SMILES CN1CCC(CC1)C(=O)N1Cc2c(NC(=O)c3ccncc3)n[nH]c2C1(C)C Show InChI InChI=1S/C20H26N6O2/c1-20(2)16-15(12-26(20)19(28)14-6-10-25(3)11-7-14)17(24-23-16)22-18(27)13-4-8-21-9-5-13/h4-5,8-9,14H,6-7,10-12H2,1-3H3,(H2,22,23,24,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Nerviano Medical Sciences Srl Curated by ChEMBL					Assay Description Inhibition of human CDK2/cyclin A expressed in Escherichia coli BL21 by scintillation proximity assay				Bioorg Med Chem 18: 1844-53 (2010) Article DOI: 10.1016/j.bmc.2010.01.042 BindingDB Entry DOI: 10.7270/Q21R6RG5
					More data for this Ligand-Target Pair