BDBM50482947 CHEMBL1270713

SMILES: CCOC(=O)N1CCC(CC1)Nc1ncc2CCc3c(cn(C)c3-c2n1)C(N)=O

InChI Key: InChIKey=OKCKMDCMHXPONP-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 = 50482947   

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
CDK2/Cyclin A/Cyclin A1 (Homo sapiens (Human))	BDBM50482947 (CHEMBL1270713) Show SMILES CCOC(=O)N1CCC(CC1)Nc1ncc2CCc3c(cn(C)c3-c2n1)C(N)=O Show InChI InChI=1S/C20H26N6O3/c1-3-29-20(28)26-8-6-13(7-9-26)23-19-22-10-12-4-5-14-15(18(21)27)11-25(2)17(14)16(12)24-19/h10-11,13H,3-9H2,1-2H3,(H2,21,27)(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Jinan University Curated by ChEMBL					Assay Description Inhibition of CDK2/cyclin A				Bioorg Med Chem Lett 20: 6764-72 (2010) Article DOI: 10.1016/j.bmcl.2010.08.131 BindingDB Entry DOI: 10.7270/Q2X069V6
					More data for this Ligand-Target Pair