BDBM50350110 CHEMBL1814068

SMILES: Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1

InChI Key: InChIKey=JNHOMPJUMGTTSC-UHFFFAOYSA-N

Data: 8 IC50

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 8 hits for monomerid = 50350110   

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
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Universidade do Porto Curated by ChEMBL					Assay Description Inhibition of human MAO-B assessed as inhibition of p-tyramine oxidation to p-hydroxyphenyl-acetaldehyde after 15 mins by fluorimetric method				J Med Chem 54: 5165-73 (2011) Article DOI: 10.1021/jm2004267 BindingDB Entry DOI: 10.7270/Q20865PP
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Inhibition of human MAO-B				Eur J Med Chem 130: 365-378 (2017) Article DOI: 10.1016/j.ejmech.2017.02.059 BindingDB Entry DOI: 10.7270/Q2K076J6
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Effective concentration for cAMP accumulation relative to alpha-MSH at human MC4R				Eur J Med Chem 130: 365-378 (2017) Article DOI: 10.1016/j.ejmech.2017.02.059 BindingDB Entry DOI: 10.7270/Q2K076J6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Porto Curated by ChEMBL					Assay Description Inhibition of human microsomal MAO-B expressed in recombinant baculovirus infected insect BTI-TN-5B1-4 cells assessed as reduction in H2O2 production...				J Med Chem 59: 5879-93 (2016) Article DOI: 10.1021/acs.jmedchem.6b00527
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Universidade do Porto Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOB				Eur J Med Chem 59: 75-90 (2013) Article DOI: 10.1016/j.ejmech.2012.10.035 BindingDB Entry DOI: 10.7270/Q2FJ2KPX
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade do Porto Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA				Eur J Med Chem 59: 75-90 (2013) Article DOI: 10.1016/j.ejmech.2012.10.035 BindingDB Entry DOI: 10.7270/Q2FJ2KPX
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Porto Curated by ChEMBL					Assay Description Inhibition of human microsomal MAO-B expressed in recombinant baculovirus infected insect BTI-TN-5B1-4 cells assessed as reduction in H2O2 production...				J Med Chem 59: 5879-93 (2016) Article DOI: 10.1021/acs.jmedchem.6b00527
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50350110 (CHEMBL1814068) Show SMILES Clc1ccc(NC(=O)c2coc3ccccc3c2=O)cc1 Show InChI InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-16(20)13-9-21-14-4-2-1-3-12(14)15(13)19/h1-9H,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Porto Curated by ChEMBL					Assay Description Inhibition of human MAO-B using p-tyramine as substrate by amplex red-based fluorescence assay				J Med Chem 60: 7941-7957 (2017) Article DOI: 10.1021/acs.jmedchem.6b01720 BindingDB Entry DOI: 10.7270/Q27083KP
					More data for this Ligand-Target Pair