BDBM50208265 CHEMBL3884787

SMILES: Cc1ccc2N(CCN3CCN(CC3)NCc3ccccc3OCc3ccccc3)C(=O)C(=O)c2c1

InChI Key: InChIKey=MIQCSJKUKHKRGU-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 = 50208265   

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 gyrase subunit B (Mycobacterium smegmatis)	BDBM50208265 (CHEMBL3884787) Show SMILES Cc1ccc2N(CCN3CCN(CC3)NCc3ccccc3OCc3ccccc3)C(=O)C(=O)c2c1 Show InChI InChI=1S/C29H32N4O3/c1-22-11-12-26-25(19-22)28(34)29(35)33(26)18-15-31-13-16-32(17-14-31)30-20-24-9-5-6-10-27(24)36-21-23-7-3-2-4-8-23/h2-12,19,30H,13-18,20-21H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
R. C. Patel Institute of Pharmaceutical Education and Research Curated by ChEMBL					Assay Description Inhibition of Mycobacterium smegmatis DNA gyrase B expressed in BL21(DE3)pLysS cells assessed as inhibition of DNA supercoiling activity in presence ...				Eur J Med Chem 124: 160-185 (2016) Article DOI: 10.1016/j.ejmech.2016.08.034 BindingDB Entry DOI: 10.7270/Q2K64M38
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