Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Dihydroorotate dehydrogenase (quinone), mitochondrial' and Ligand = 'BDBM490472'   

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))	BDBM490472 (N-[4-amino-2-(trifluoromethyl)phenyl]-2-[(1S)-1-cy...) Show SMILES C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(N)cc1C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r| Show InChI InChI=1S/C28H31F4N5O3/c1-16(17-7-3-2-4-8-17)40-24-15-23(37-27(39)36-12-6-5-9-25(36)35-37)21(29)14-19(24)26(38)34-22-11-10-18(33)13-20(22)28(30,31)32/h10-11,13-17H,2-9,12,33H2,1H3,(H,34,38)/t16-/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	5	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
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM490472 (N-[4-amino-2-(trifluoromethyl)phenyl]-2-[(1S)-1-cy...) Show SMILES C[C@H](Oc1cc(c(F)cc1C(=O)Nc1ccc(N)cc1C(F)(F)F)-n1nc2CCCCn2c1=O)C1CCCCC1 |r| Show InChI InChI=1S/C28H31F4N5O3/c1-16(17-7-3-2-4-8-17)40-24-15-23(37-27(39)36-12-6-5-9-25(36)35-37)21(29)14-19(24)26(38)34-22-11-10-18(33)13-20(22)28(30,31)32/h10-11,13-17H,2-9,12,33H2,1H3,(H,34,38)/t16-/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	128	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—2: 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
					More data for this Ligand-Target Pair