BDBM50490567 CHEMBL2338467

SMILES: COc1c(N2CCNC(C2)C(O)=O)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1

InChI Key: InChIKey=DHQKMDASURGTBV-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 = 50490567   

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 tuberculosis (strain ATCC 25618 / H3...)	BDBM50490567 (CHEMBL2338467) Show SMILES COc1c(N2CCNC(C2)C(O)=O)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1 Show InChI InChI=1S/C19H20FN3O6/c1-29-17-14-10(16(24)11(18(25)26)7-23(14)9-2-3-9)6-12(20)15(17)22-5-4-21-13(8-22)19(27)28/h6-7,9,13,21H,2-5,8H2,1H3,(H,25,26)(H,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Diderot Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis DNA gyrase GyrA/GyrB assessed as reduction of enzyme supercoiling activity using relaxed pBR322 DNA substrat...				Bioorg Med Chem 21: 948-56 (2013) Article DOI: 10.1016/j.bmc.2012.12.011 BindingDB Entry DOI: 10.7270/Q2FF3W92
					More data for this Ligand-Target Pair