BDBM15586 N-(2-Phenylethyl),N-methyl-1H-pyrrole-2-carboxamide::N-methyl-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide::pyrrole inhibitor 12

SMILES: CN(CCc1ccccc1)C(=O)c1ccc[nH]1

InChI Key: InChIKey=OPVTYGJORIMKNX-UHFFFAOYSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 15586   

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
Monoamine Oxidase Type A (MAO-A) (Bos taurus)	BDBM15586 (N-(2-Phenylethyl),N-methyl-1H-pyrrole-2-carboxamid...) Show SMILES CN(CCc1ccccc1)C(=O)c1ccc[nH]1 Show InChI InChI=1S/C14H16N2O/c1-16(14(17)13-8-5-10-15-13)11-9-12-6-3-2-4-7-12/h2-8,10,15H,9,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	7	-11.6	n/a	n/a	n/a	n/a	n/a	7.4	38
Universita di Roma La Sapienza					Assay Description MAO A and MAO B activities were determined spectrophotometrically using kinuramine as substrates. Fluorimetric measurements were recorded with a Perk...				J Med Chem 50: 922-31 (2007) Article DOI: 10.1021/jm060882y BindingDB Entry DOI: 10.7270/Q2GH9G61
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Bos taurus)	BDBM15586 (N-(2-Phenylethyl),N-methyl-1H-pyrrole-2-carboxamid...) Show SMILES CN(CCc1ccccc1)C(=O)c1ccc[nH]1 Show InChI InChI=1S/C14H16N2O/c1-16(14(17)13-8-5-10-15-13)11-9-12-6-3-2-4-7-12/h2-8,10,15H,9,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita di Roma La Sapienza					Assay Description MAO A and MAO B activities were determined spectrophotometrically using kinuramine as substrates. Fluorimetric measurements were recorded with a Perk...				J Med Chem 50: 922-31 (2007) Article DOI: 10.1021/jm060882y BindingDB Entry DOI: 10.7270/Q2GH9G61
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM15586 (N-(2-Phenylethyl),N-methyl-1H-pyrrole-2-carboxamid...) Show SMILES CN(CCc1ccccc1)C(=O)c1ccc[nH]1 Show InChI InChI=1S/C14H16N2O/c1-16(14(17)13-8-5-10-15-13)11-9-12-6-3-2-4-7-12/h2-8,10,15H,9,11H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	7.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bharati Vidyapeeth Deemed University Curated by ChEMBL					Assay Description Inhibition of MAO-A receptor				Bioorg Med Chem Lett 21: 2419-24 (2011) Article DOI: 10.1016/j.bmcl.2011.02.072 BindingDB Entry DOI: 10.7270/Q2QZ2C6S
					More data for this Ligand-Target Pair