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SMILES: CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C#N

InChI Key: InChIKey=DWGBXJYQPSMSOV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50071388   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))		BDBM50071388
PNG
(5-Hexyl-isoxazole-4-carbothioic acid (4-cyano-phen...)
Show SMILES CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C17H19N3OS/c1-2-3-4-5-6-16-15(12-19-21-16)17(22)20-14-9-7-13(11-18)8-10-14/h7-10,12H,2-6H2,1H3,(H,20,22)
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/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