Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Dihydroorotate dehydrogenase (quinone), mitochondrial' and Ligand = 'BDBM470395'   

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))	BDBM470395 (4-(3-cyclopropyl-4-ethyl-5-oxo-4,5-dihydro-1H-1,2,...) Show SMILES CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O)C1CC1 |r| Show InChI InChI=1S/C24H23F5N4O3/c1-4-32-21(14-8-9-14)31-33(23(32)35)18-11-19(36-13(3)24(27,28)29)15(10-17(18)26)22(34)30-20-12(2)6-5-7-16(20)25/h5-7,10-11,13-14H,4,8-9H2,1-3H3,(H,30,34)/t13-/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	6.05	n/a	n/a	n/a	n/a	n/a	n/a
BAYER AKTIENGESELLSCHAFT; BAYER PHARMA AKTIENGELLSCHAFT; 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 US10815215 (2020) BindingDB Entry DOI: 10.7270/Q2RJ4NJH
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM470395 (4-(3-cyclopropyl-4-ethyl-5-oxo-4,5-dihydro-1H-1,2,...) Show SMILES CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O)C1CC1 |r| Show InChI InChI=1S/C24H23F5N4O3/c1-4-32-21(14-8-9-14)31-33(23(32)35)18-11-19(36-13(3)24(27,28)29)15(10-17(18)26)22(34)30-20-12(2)6-5-7-16(20)25/h5-7,10-11,13-14H,4,8-9H2,1-3H3,(H,30,34)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.05	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2HQ4414
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM470395 (4-(3-cyclopropyl-4-ethyl-5-oxo-4,5-dihydro-1H-1,2,...) Show SMILES CCn1c(nn(-c2cc(O[C@@H](C)C(F)(F)F)c(cc2F)C(=O)Nc2c(C)cccc2F)c1=O)C1CC1 |r| Show InChI InChI=1S/C24H23F5N4O3/c1-4-32-21(14-8-9-14)31-33(23(32)35)18-11-19(36-13(3)24(27,28)29)15(10-17(18)26)22(34)30-20-12(2)6-5-7-16(20)25/h5-7,10-11,13-14H,4,8-9H2,1-3H3,(H,30,34)/t13-/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	6.05	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The enzymatic assay couples DHODH activity with bleaching of the dye 2,6-dichlorophenolindophenol (DCIP) (Knecht and Loffler, 1998; Miller et al., 19...				Citation and Details BindingDB Entry DOI: 10.7270/Q20C4ZXM
					More data for this Ligand-Target Pair