BDBM50095648 CHEMBL3623270

SMILES: COc1ccc(\C=C2\NC(=S)NC2=O)cc1

InChI Key: InChIKey=ZNYFOVSQSAVTHE-UHFFFAOYSA-N

Data: 1 EC50

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 = 50095648   

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
DNA topoisomerase I (Topo I) (Homo sapiens (Human))	BDBM50095648 (CHEMBL3623270) Show SMILES COc1ccc(\C=C2\NC(=S)NC2=O)cc1 Show InChI InChI=1S/C8H9ClN8O2/c1-11-8(15-17(18)19)13-4-5-2-6(14-16-10)7(9)12-3-5/h2-3H,4H2,1H3,(H2,11,13,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Shiv Nadar University Curated by ChEMBL					Assay Description Inhibition of wild type recombinant human Top1 expressed in baculovirus infected insect Sf9 cells assessed as decrease in supercoiled pBS(SK+) DNA is...				Eur J Med Chem 102: 540-51 (2015) BindingDB Entry DOI: 10.7270/Q2FB54SZ
					More data for this Ligand-Target Pair