BDBM50060697 CHEMBL3394707

SMILES: COc1cc2CCN3C(=O)c4ccccc4C3(O)c2cc1O

InChI Key: InChIKey=QDNPXRZHFSFVJG-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 = 50060697   

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))	BDBM50060697 (CHEMBL3394707) Show SMILES COc1cc2CCN3C(=O)c4ccccc4C3(O)c2cc1O Show InChI InChI=1S/C17H15NO4/c1-22-15-8-10-6-7-18-16(20)11-4-2-3-5-12(11)17(18,21)13(10)9-14(15)19/h2-5,8-9,19,21H,6-7H2,1H3	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	216	n/a	n/a	n/a	n/a	n/a	n/a
Pondicherry University Curated by ChEMBL					Assay Description Inhibition of PARP1 (unknown origin) in presence of NAD+ by homogenous fluorescence plate assay				Bioorg Med Chem 23: 488-98 (2015) Article DOI: 10.1016/j.bmc.2014.12.017 BindingDB Entry DOI: 10.7270/Q2BV7J9N
					More data for this Ligand-Target Pair