BDBM50080630 (2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-[(1,2-diphenyl-ethylcarbamoyl)-methyl]-2-(4-methoxy-phenyl)-pyrrolidine-3-carboxylic acid; TFA::CHEMBL122614::CHEMBL427303

SMILES COc1ccc(cc1)[C@H]1[C@@H]([C@H](CN1CC(=O)NC(Cc1ccccc1)c1ccccc1)c1ccc2OCOc2c1)C(O)=O

InChI Key InChIKey=MRBWXOFHOJHYOZ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50080630   

TargetEndothelin receptor type B(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50080630(CHEMBL122614 | CHEMBL427303 | (2R,3R,4S)-4-Benzo[1...)
Affinity DataIC50: 47nMAssay Description:Binding ability determined by the displacement of [125 I]ET-3 from the human Endothelin B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50080630(CHEMBL122614 | CHEMBL427303 | (2R,3R,4S)-4-Benzo[1...)
Affinity DataIC50: 3.90nMAssay Description:Binding ability determined by the displacement of [125I]ET1 from the human endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Rat)
University of Innsbruck

Curated by ChEMBL
LigandPNGBDBM50080630(CHEMBL122614 | CHEMBL427303 | (2R,3R,4S)-4-Benzo[1...)
Affinity DataIC50: 3.90nMAssay Description:Ability to displace [125I]ET1 from the rat endothelin A receptor expressed in rat aorta smooth muscle cells.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed