BDBM50482970 CHEMBL1271017

SMILES: CN1CCN(CC1)c1ccc(CNc2ncc3CCc4c(cn(C)c4-c3n2)C(N)=O)cc1

InChI Key: InChIKey=VBIZVJHNGIEVRC-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 = 50482970   

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))	BDBM50482970 (CHEMBL1271017) Show SMILES CN1CCN(CC1)c1ccc(CNc2ncc3CCc4c(cn(C)c4-c3n2)C(N)=O)cc1 Show InChI InChI=1S/C24H29N7O/c1-29-9-11-31(12-10-29)18-6-3-16(4-7-18)13-26-24-27-14-17-5-8-19-20(23(25)32)15-30(2)22(19)21(17)28-24/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H2,25,32)(H,26,27,28)	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	17	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