BDBM50510289 CHEMBL4588294

SMILES: NC[C@H](Oc1n[nH]c2ccc(cc12)-c1ccccc1Cl)c1ccccc1

InChI Key: InChIKey=JZDOYHINLKPXOF-FQEVSTJZSA-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 = 50510289   

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 (Escherichia coli (strain K12))	BDBM50510289 (CHEMBL4588294) Show SMILES NC[C@H](Oc1n[nH]c2ccc(cc12)-c1ccccc1Cl)c1ccccc1 |r| Show InChI InChI=1S/C21H18ClN3O/c22-18-9-5-4-8-16(18)15-10-11-19-17(12-15)21(25-24-19)26-20(13-23)14-6-2-1-3-7-14/h1-12,20H,13,23H2,(H,24,25)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of Escherichia coli his-tagged DNA gyrase supercoiling activity using pBR322 DNA in presence of ATP incubated for 1 hr by H19 dye based hi...				Bioorg Med Chem Lett 29: 1407-1412 (2019) Article DOI: 10.1016/j.bmcl.2019.03.029
					More data for this Ligand-Target Pair