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SMILES: Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(OCc3ccccc3)cc2)c(F)c1F

InChI Key: InChIKey=CVWHAKKPTAXDGE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 155485   
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))		BDBM155485
PNG
(US9006454, I127)
Show SMILES Cc1cc(C(O)=O)c2nc([nH]c2c1)-c1c(F)c(F)c(-c2ccc(OCc3ccccc3)cc2)c(F)c1F
Show InChI InChI=1S/C28H18F4N2O3/c1-14-11-18(28(35)36)26-19(12-14)33-27(34-26)21-24(31)22(29)20(23(30)25(21)32)16-7-9-17(10-8-16)37-13-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,33,34)(H,35,36)
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Similars
US Patent
n/an/a 48n/an/an/an/a8.0n/a



Merck Serono S.A.

US Patent


Assay Description
The DHODH activity assay is a coupled enzyme assay in which oxidation of DHO and subsequent reduction of ubiquinone are stoichiometrically equivalent...

US Patent US9006454 (2015)


BindingDB Entry DOI: 10.7270/Q2125RCJ
More data for this
Ligand-Target Pair