null

SMILES: NCCO.CC(C)(C)OC(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O

InChI Key: InChIKey=GIIYNVYPTGTDPX-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50211949   

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))	BDBM50211949 (CHEMBL3952177) Show SMILES NCCO.CC(C)(C)OC(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C13H19N3O6/c1-13(2,3)22-12(21)14-6-4-5-7-8(10(18)19)15-11(20)16-9(7)17/h4-6H2,1-3H3,(H,14,21)(H,18,19)(H2,15,16,17,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>3.13E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagasaki University Curated by ChEMBL					Assay Description Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi...				Bioorg Med Chem 25: 1465-1470 (2017) Article DOI: 10.1016/j.bmc.2017.01.009 BindingDB Entry DOI: 10.7270/Q2CC12TS
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM50211949 (CHEMBL3952177) Show SMILES NCCO.CC(C)(C)OC(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C13H19N3O6/c1-13(2,3)22-12(21)14-6-4-5-7-8(10(18)19)15-11(20)16-9(7)17/h4-6H2,1-3H3,(H,14,21)(H,18,19)(H2,15,16,17,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>625	n/a	n/a	n/a	n/a	n/a	n/a
Nagasaki University Curated by ChEMBL					Assay Description Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi...				Bioorg Med Chem 25: 1465-1470 (2017) Article DOI: 10.1016/j.bmc.2017.01.009 BindingDB Entry DOI: 10.7270/Q2CC12TS
					More data for this Ligand-Target Pair