null

SMILES: CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O

InChI Key: InChIKey=NJFTUTWPOXOOJE-INIZCTEOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 470357   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/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	5.33	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))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/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	1.30E+4	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 2: 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))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.30E+4	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))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/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	1.30E+4	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
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.33	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))	BDBM470357 (4-(3-ethyl-4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-tri...) Show SMILES CCC[C@H](C)Oc1cc(c(F)cc1C(=O)Nc1ccccc1C)-n1nc(CC)n(C)c1=O |r| Show InChI InChI=1S/C24H29FN4O3/c1-6-10-16(4)32-21-14-20(29-24(31)28(5)22(7-2)27-29)18(25)13-17(21)23(30)26-19-12-9-8-11-15(19)3/h8-9,11-14,16H,6-7,10H2,1-5H3,(H,26,30)/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	5.33	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