BDBM7259 (3Z)-4-(2-hydroxyethyl)-3-({4-oxo-2H,4H,5H,6H,7H-pyrrolo[3,4-c]pyridin-1-yl}methylidene)-2,3-dihydro-1H-indol-2-one::pyrrollylactam indolinone driv. 16k

SMILES: OCCc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCNC4=O)c12

InChI Key: InChIKey=NJMMRCLGMDYDCP-WQLSENKSSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 7259   

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/CycE (Homo sapiens (Human))	BDBM7259 ((3Z)-4-(2-hydroxyethyl)-3-({4-oxo-2H,4H,5H,6H,7H-p...) Show SMILES OCCc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCNC4=O)c12 Show InChI InChI=1S/C18H17N3O3/c22-7-5-10-2-1-3-14-16(10)12(18(24)21-14)8-15-11-4-6-19-17(23)13(11)9-20-15/h1-3,8-9,20,22H,4-7H2,(H,19,23)(H,21,24)/b12-8-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	7.4	22
SUGEN, Inc.					Assay Description For the assay, purified cdk/cyclin was added to polystyrene 96-well plates that were precoated with GST-Rb substrate in the presence of ATP. After i...				Bioorg Med Chem Lett 13: 1939-42 (2003) Article DOI: 10.1016/s0960-894x(03)00312-3 BindingDB Entry DOI: 10.7270/Q2HD7SW7
					More data for this Ligand-Target Pair