null

SMILES: CS(=O)(=O)Nc1ccc(cc1)-c1coc2cc(ccc2c1=O)C#CC1CN(C1)C(=O)C1CC1(F)F

InChI Key: InChIKey=DMDVCUMKZDMAME-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 118228   

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
Aldehyde dehydrogenase, mitochondrial (Homo sapiens (Human))	BDBM118228 (US8673966, N-(4-(7-((1-(2,2-difluorocyclopropane- ...) Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1coc2cc(ccc2c1=O)C#CC1CN(C1)C(=O)C1CC1(F)F Show InChI InChI=1S/C25H20F2N2O5S/c1-35(32,33)28-18-7-5-17(6-8-18)20-14-34-22-10-15(4-9-19(22)23(20)30)2-3-16-12-29(13-16)24(31)21-11-25(21,26)27/h4-10,14,16,21,28H,11-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	7.4	n/a
Gilead Sciences, Inc. US Patent					Assay Description Standard ALDH2 reaction mixtures contained 150 uM formaldehyde, 2.5 mM NAD+, 10 mM MgCl2 and 10 nM recombinant human ALDH2 in 50 mM Hepes buffer, pH ...				US Patent US8673966 (2014) BindingDB Entry DOI: 10.7270/Q2QZ28MX
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM118228 (US8673966, N-(4-(7-((1-(2,2-difluorocyclopropane- ...) Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1coc2cc(ccc2c1=O)C#CC1CN(C1)C(=O)C1CC1(F)F Show InChI InChI=1S/C25H20F2N2O5S/c1-35(32,33)28-18-7-5-17(6-8-18)20-14-34-22-10-15(4-9-19(22)23(20)30)2-3-16-12-29(13-16)24(31)21-11-25(21,26)27/h4-10,14,16,21,28H,11-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.30E+5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Sciences, Inc. US Patent					Assay Description MAO assays included luminogenic MAO substrate, reaction buffers, Luciferin Detection and the reconstitution buffer with esterase. Standard MAO reacti...				US Patent US8673966 (2014) BindingDB Entry DOI: 10.7270/Q2QZ28MX
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM118228 (US8673966, N-(4-(7-((1-(2,2-difluorocyclopropane- ...) Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1coc2cc(ccc2c1=O)C#CC1CN(C1)C(=O)C1CC1(F)F Show InChI InChI=1S/C25H20F2N2O5S/c1-35(32,33)28-18-7-5-17(6-8-18)20-14-34-22-10-15(4-9-19(22)23(20)30)2-3-16-12-29(13-16)24(31)21-11-25(21,26)27/h4-10,14,16,21,28H,11-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.30E+5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Sciences, Inc. US Patent					Assay Description MAO assays included luminogenic MAO substrate, reaction buffers, Luciferin Detection and the reconstitution buffer with esterase. Standard MAO reacti...				US Patent US8673966 (2014) BindingDB Entry DOI: 10.7270/Q2QZ28MX
					More data for this Ligand-Target Pair