BDBM50405108 CHEMBL54632

SMILES: CCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1C

InChI Key: InChIKey=BKBQMDGKXQEVRZ-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50405108   

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 III (Bacillus subtilis)	BDBM50405108 (CHEMBL54632) Show SMILES CCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1C Show InChI InChI=1S/C14H17N3O2/c1-3-4-10-5-6-11(7-9(10)2)15-12-8-13(18)17-14(19)16-12/h5-8H,3-4H2,1-2H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition constant against Bacillus subtilis azp-12 DNA topoisomerase III (mutant enzyme).				J Med Chem 27: 181-5 (1984) BindingDB Entry DOI: 10.7270/Q2Q241FK
					More data for this Ligand-Target Pair
DNA topoisomerase III (Bacillus subtilis)	BDBM50405108 (CHEMBL54632) Show SMILES CCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1C Show InChI InChI=1S/C14H17N3O2/c1-3-4-10-5-6-11(7-9(10)2)15-12-8-13(18)17-14(19)16-12/h5-8H,3-4H2,1-2H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.79E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition constant against Bacillus subtilis DNA topoisomerase III (wild type).				J Med Chem 27: 181-5 (1984) BindingDB Entry DOI: 10.7270/Q2Q241FK
					More data for this Ligand-Target Pair