BDBM50154736 6-(4-Fluoro-phenyl)-7-(2H-pyrazol-3-yl)-3,4-dihydro-2H-[1,4]diazepino[6,7,1-hi]indol-1-one::CHEMBL360820

SMILES: Fc1ccc(cc1)-c1c(-c2cc[nH]n2)c2cccc3C(=O)NCCn1c23

InChI Key: InChIKey=QLAWXEAEDQPMMS-UHFFFAOYSA-N

Data: 1 KI

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 = 50154736   

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
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50154736 (6-(4-Fluoro-phenyl)-7-(2H-pyrazol-3-yl)-3,4-dihydr...) Show SMILES Fc1ccc(cc1)-c1c(-c2cc[nH]n2)c2cccc3C(=O)NCCn1c23 Show InChI InChI=1S/C20H15FN4O/c21-13-6-4-12(5-7-13)18-17(16-8-9-23-24-16)14-2-1-3-15-19(14)25(18)11-10-22-20(15)26/h1-9H,10-11H2,(H,22,26)(H,23,24)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	249	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global R&D--La Jolla Laboratories Curated by ChEMBL					Assay Description Inhibition of human Poly (ADP-ribose) polymerase 1 enzyme				J Med Chem 47: 5467-81 (2004) Article DOI: 10.1021/jm030513r BindingDB Entry DOI: 10.7270/Q2PK0FM4
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