BDBM50202863 CHEMBL3896944

SMILES: [Br-].Clc1cccc(C[n+]2ccc3ccnc4-c5ccccc5-c2c34)c1

InChI Key: InChIKey=GIUYJEFFJOXJHF-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 = 50202863   

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))	BDBM50202863 (CHEMBL3896944) Show SMILES [Br-].Clc1cccc(C[n+]2ccc3ccnc4-c5ccccc5-c2c34)c1 Show InChI InChI=1S/C21H14ClN2/c22-16-5-3-4-14(12-16)13-24-11-9-15-8-10-23-20-17-6-1-2-7-18(17)21(24)19(15)20/h1-12H,13H2/q+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Southern Research Institute Curated by ChEMBL					Assay Description Inhibition of human DNA topoisomerase 1 using pHOT1 as substrate after 30 mins by agarose gel electrophoresis				Bioorg Med Chem 24: 6119-6130 (2016) Article DOI: 10.1016/j.bmc.2016.02.028 BindingDB Entry DOI: 10.7270/Q2BG2QZJ
					More data for this Ligand-Target Pair