BDBM50332729 (4S,7R,10S,13R,16R,19S)-16-(2-amino-2-oxoethyl)-13-(3-amino-3-oxopropyl)-19-((R)-1-((R)-2-(2-aminoacetamido)-4-methylpentanoyl)pyrrolidine-2-carboxamido)-10-sec-butyl-7-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxylic acid::CHEMBL1630534

SMILES CC[C@@H](C)[C@@H]1NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](CSSC[C@@H](NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O)C(O)=O)NC(=O)[C@H]1CCCN1C(=O)[C@@H](CC(C)C)NC(=O)CN

InChI Key InChIKey=XTBKTMLALBDASM-UHFFFAOYSA-N

Data  1 KI  1 EC50

  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 2 hits for monomerid = 50332729   

TargetOxytocin receptor(Human)
The University of Queensland

Curated by ChEMBL
LigandPNGBDBM50332729((4S,7R,10S,13R,16R,19S)-16-(2-amino-2-oxoethyl)-13...)
Affinity DataEC50: >1.00E+5nMAssay Description:Activity at oxytocin receptor expressed in COS1 cells assessed as IP-one generation by HTRF assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2011
Entry Details Article
PubMed
TargetOxytocin receptor(Human)
The University of Queensland

Curated by ChEMBL
LigandPNGBDBM50332729((4S,7R,10S,13R,16R,19S)-16-(2-amino-2-oxoethyl)-13...)
Affinity DataKi: >1.00E+5nMAssay Description:Displacement of [3H]OT from oxytocin receptor expressed in COS1 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2011
Entry Details Article
PubMed