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SMILES: OC(=O)C1=C(CCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1

InChI Key: InChIKey=KZXZZOMEQFFRIF-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50173150   
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))		BDBM50173150
PNG
(2-(4-Benzyloxy-phenylcarbamoyl)-cyclopent-1-enecar...)
Show SMILES OC(=O)C1=C(CCC1)C(=O)Nc1ccc(OCc2ccccc2)cc1 |t:3|
Show InChI InChI=1S/C20H19NO4/c22-19(17-7-4-8-18(17)20(23)24)21-15-9-11-16(12-10-15)25-13-14-5-2-1-3-6-14/h1-3,5-6,9-12H,4,7-8,13H2,(H,21,22)(H,23,24)
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n/an/a 2.00E+3n/an/an/an/an/an/a



4SC AG

Curated by ChEMBL


Assay Description
Inhibition of N-terminally truncated recombinant human dihydroorotate dehydrogenase using in vitro enzyme assay

Bioorg Med Chem Lett 15: 4854-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.053
BindingDB Entry DOI: 10.7270/Q2HX1C7N
More data for this
Ligand-Target Pair