BDBM50008745 CHEMBL3236329

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](N)Cc3ccc(O)cc3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key InChIKey=IWCGRJRLSWGIIP-UHFFFAOYSA-N

Data  24 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 4 hits for monomerid = 50008745   

TargetKappa-type opioid receptor(Human)
University of California

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50008745BDBM50008745([Pro3]Dyn A(1-11)-NH2)
Affinity DataKi:  2.40nMAssay Description:In vitro binding affinity towards human Opioid receptor kappa 1 on CHO cell membranes using [3H]diprenorphine displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
University of California

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50008745BDBM50008745([Pro3]Dyn A(1-11)-NH2)
Affinity DataIC50: 440nMAssay Description:Antagonistic activity in theOpioid receptor kappa 1 -mediated [35S]GTP-gamma-S, binding assay against 50 nM U-50,488More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
University of California

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50008745BDBM50008745([Pro3]Dyn A(1-11)-NH2)
Affinity DataKi:  5.25E+3nMAssay Description:In vitro binding affinity to human Opioid receptor mu 1 on CHO cell membranes using [3H]diprenorphine displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
University of California

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50008745BDBM50008745([Pro3]Dyn A(1-11)-NH2)
Affinity DataKi:  8.90E+3nMAssay Description:In vitro binding affinity to human Opioid receptor delta 1 on CHO cell membranes using [3H]diprenorphine displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/27/2012
Entry Details Article
PubMed