Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dihydroorotate dehydrogenase (quinone), mitochondrial' and Ligand = 'BDBM490396'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM490396 (5-fluoro-N-(4-fluoro-2,6-dimethylphenyl)-4-(3-oxo-...) Show SMILES C[C@H](Oc1cc(c(F)cc1C(=O)Nc1c(C)cc(F)cc1C)-n1nc2CCCCn2c1=O)C(F)(F)F |r| Show InChI InChI=1S/C24H23F5N4O3/c1-12-8-15(25)9-13(2)21(12)30-22(34)16-10-17(26)18(11-19(16)36-14(3)24(27,28)29)33-23(35)32-7-5-4-6-20(32)31-33/h8-11,14H,4-7H2,1-3H3,(H,30,34)/t14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
BAYER AKTIENGESELLSCHAFT; BAYER PHARMA AKTIENGESELLSCHAFT; THE BROAD INSTITUTE, INC.; PRESIDENT AND FELLOWS OF HARVARD COLLEGE; THE GENERAL HOSPITAL CORPORATION US Patent					Assay Description Assay—1: The enzymatic assay couples DHODH activity with bleaching of the dye 2,6-dichlorophenolindophenol (DCIP) (Knecht and Loffler, 1998; Miller e...				US Patent US10968216 (2021) BindingDB Entry DOI: 10.7270/Q2WM1HJN
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