BDBM50543961 CHEMBL4647427

SMILES: [O-][N+](=O)c1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc2c(c1)oc(cc2=O)-c1ccccc1

InChI Key: InChIKey=POQDEQXUQQWITL-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 = 50543961   

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
Topoisomerase I/II (Homo sapiens (Human))	BDBM50543961 (CHEMBL4647427) Show SMILES [O-][N+](=O)c1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc2c(c1)oc(cc2=O)-c1ccccc1 Show InChI InChI=1S/C22H13F3N2O6S/c23-22(24,25)17-11-15(7-9-18(17)27(29)30)34(31,32)26-14-6-8-16-19(28)12-20(33-21(16)10-14)13-4-2-1-3-5-13/h1-12,26H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
Prof John Barnabas Post Graduate School of Biological Studies Curated by ChEMBL					Assay Description Inhibition of human DNA topoisomerase 2 catalytic activity using supercoiled pRYG DNA as substrate measured after 45 mins in presence of ATP by agaro...				Bioorg Med Chem Lett 30: (2020)
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