BDBM50071393 5-Ethyl-isoxazole-4-carbothioic acid (4-trifluoromethoxy-phenyl)-amide::CHEMBL306784

SMILES: CCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=LPSPGMRRGMGLRZ-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 = 50071393   

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
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM50071393 (5-Ethyl-isoxazole-4-carbothioic acid (4-trifluorom...) Show SMILES CCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C13H11F3N2O2S/c1-2-11-10(7-17-20-11)12(21)18-8-3-5-9(6-4-8)19-13(14,15)16/h3-7H,2H2,1H3,(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharma AG Curated by ChEMBL					Assay Description Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)				Bioorg Med Chem Lett 8: 2203-8 (1999) BindingDB Entry DOI: 10.7270/Q2QN65X4
					More data for this Ligand-Target Pair