Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 247.2 BDBM50271179

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 4 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
EEF1AKMT4-ECE2 readthrough transcript protein (Homo sapiens (Human))	BDBM50271179 (2-(2-(quinolin-2-yl)vinyl)phenol | CHEMBL487942 | ...) Show SMILES Oc1ccccc1\C=C/c1ccc2ccccc2n1 Show InChI InChI=1S/C17H13NO/c19-17-8-4-2-6-14(17)10-12-15-11-9-13-5-1-3-7-16(13)18-15/h1-12,19H/b12-10-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	5.5	n/a
Icahn School of Medicine at Mount Sinai					Assay Description Recombinant ECE2 (32.5 ng) with a specific activity of 12 pmol/min/μg protein was generated as described previously. Secreted soluble recombinan...				J Biol Chem 289: 19613-26 (2014) Article DOI: 10.1074/jbc.M113.537704 BindingDB Entry DOI: 10.7270/Q2VD6XBF
					More data for this Ligand-Target Pair
EEF1AKMT4-ECE2 readthrough transcript protein (Homo sapiens (Human))	BDBM50271179 (2-(2-(quinolin-2-yl)vinyl)phenol | CHEMBL487942 | ...) Show SMILES Oc1ccccc1\C=C/c1ccc2ccccc2n1 Show InChI InChI=1S/C17H13NO/c19-17-8-4-2-6-14(17)10-12-15-11-9-13-5-1-3-7-16(13)18-15/h1-12,19H/b12-10-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Mount Sinai School of Medicine Curated by ChEMBL					Assay Description Reduction of recombinant ECE2 (unknown origin) activity measured by McaBk2 fluorescent substrate hydrolysis				J Med Chem 51: 3378-87 (2008) Article DOI: 10.1021/jm7015478 BindingDB Entry DOI: 10.7270/Q2319VN5
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50271179 (2-(2-(quinolin-2-yl)vinyl)phenol | CHEMBL487942 | ...) Show SMILES Oc1ccccc1\C=C/c1ccc2ccccc2n1 Show InChI InChI=1S/C17H13NO/c19-17-8-4-2-6-14(17)10-12-15-11-9-13-5-1-3-7-16(13)18-15/h1-12,19H/b12-10-	PDB UniProtKB/SwissProt 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	7.4	n/a
Icahn School of Medicine at Mount Sinai					Assay Description Recombinant ECE2 (32.5 ng) with a specific activity of 12 pmol/min/μg protein was generated as described previously. Secreted soluble recombinan...				J Biol Chem 289: 19613-26 (2014) Article DOI: 10.1074/jbc.M113.537704 BindingDB Entry DOI: 10.7270/Q2VD6XBF
					More data for this Ligand-Target Pair
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50271179 (2-(2-(quinolin-2-yl)vinyl)phenol | CHEMBL487942 | ...) Show SMILES Oc1ccccc1\C=C/c1ccc2ccccc2n1 Show InChI InChI=1S/C17H13NO/c19-17-8-4-2-6-14(17)10-12-15-11-9-13-5-1-3-7-16(13)18-15/h1-12,19H/b12-10-	PDB UniProtKB/SwissProt 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	5.5	n/a
Icahn School of Medicine at Mount Sinai					Assay Description Recombinant ECE2 (32.5 ng) with a specific activity of 12 pmol/min/μg protein was generated as described previously. Secreted soluble recombinan...				J Biol Chem 289: 19613-26 (2014) Article DOI: 10.1074/jbc.M113.537704 BindingDB Entry DOI: 10.7270/Q2VD6XBF
					More data for this Ligand-Target Pair