BDBM50154753 7-(1-Hydroxy-ethyl)-3,4-dihydro-2H-[1,4]diazepino[6,7,1-hi]indol-1-one::CHEMBL362568

SMILES: CC(O)c1cn2CCNC(=O)c3cccc1c23

InChI Key: InChIKey=ORGASAWJOVWBIJ-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 = 50154753   

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))	BDBM50154753 (7-(1-Hydroxy-ethyl)-3,4-dihydro-2H-[1,4]diazepino[...) Show SMILES CC(O)c1cn2CCNC(=O)c3cccc1c23 Show InChI InChI=1S/C13H14N2O2/c1-8(16)11-7-15-6-5-14-13(17)10-4-2-3-9(11)12(10)15/h2-4,7-8,16H,5-6H2,1H3,(H,14,17)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	692	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
					More data for this Ligand-Target Pair