BDBM50097579 (6S,11R)-3-Cyclopropylmethyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocine-8-carboxylic acid amide::8-CAC::8-carboxamidocyclazocine::CHEMBL58646::US9656961, Example 00157

SMILES C[C@H]1C2Cc3ccc(cc3[C@@]1(C)CCN2CC1CC1)C(N)=O

InChI Key InChIKey=FAVQVALXVLMHLE-UHFFFAOYSA-N

Data  18 KI  4 IC50  4 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 26 hits for monomerid = 50097579   

TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataIC50: 21nMAssay Description:Antagonist activity against human mu opioid receptor expressed in CHO cells assessed as inhibition of DAMGO-stimulated [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataIC50: 5.20nMAssay Description:The Ki (binding affinity) for opioid receptors was determined using a competitive displacement assay as previously described in Neumeyer (Journal of ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2019
Entry Details
Go to US Patent

TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataEC50:  2.60nMAssay Description:The Ki (binding affinity) for opioid receptors was determined using a competitive displacement assay as previously described in Neumeyer (Journal of ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2019
Entry Details
Go to US Patent

TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataIC50: 5.60nMAssay Description:Partial agonist activity at human mu opioid receptor expressed in CHO cell membrane assessed as inhibition of DAMGO-induced [35S]GTPgammaS binding af...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataEC50:  4.40nMAssay Description:Displacement of [3H]DAMGO from human kappa opioid receptor expressed in CHO cell membrane after 60 mins by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataIC50: 21nMAssay Description:Antagonist activity against human mu opioid receptor expressed in CHO cells assessed as inhibition of DAMGO-stimulated [35S]GTPgammaS bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataEC50:  2.70nMAssay Description:Partial agonist activity at human mu opioid receptor expressed in CHO cell membrane assessed as stimulation of [35S]GTPgammaS binding after 60 mins b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataEC50:  4.40nMAssay Description:Antagonist activity against human kappa opioid receptor expressed in CHO cells assessed as inhibition of U50488-stimulated [35S]GTP-gamma-S bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.0600nMAssay Description:Displacement of [3H]U69,593 from human kappa opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.0600nMAssay Description:Displacement of [3H]U-69593 from human kappa opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.0600nMAssay Description:Displacement of [3H]U-69593 from kappa opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.170nMAssay Description:The Ki (binding affinity) for opioid receptors was determined using a competitive displacement assay as previously described in Neumeyer (Journal of ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2019
Entry Details
Go to US Patent

TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.310nMAssay Description:Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.310nMAssay Description:Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.310nMAssay Description:Displacement of [3H]DAMGO from mu opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.340nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2012
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.410nMAssay Description:Binding affinity was determined towards opioid receptor mu1 using [3H]DAMGO as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMu-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.410nMAssay Description:Displacement of [3H]DAMGO from Opioid receptor mu 1 of guinea pig brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.420nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/9/2012
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.530nMAssay Description:Displacement of [3H]U-69593 from Opioid receptor kappa 1 of guinea pig brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Guinea pig)
University of Rochester

Curated by PDSP Ki Database
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  0.530nMAssay Description:Binding affinity was determined towards opioid receptor kappa 1 using [3H]U-69593 as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  5.20nMAssay Description:Displacement of [3H]naltrindole from human delta opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  5.20nMAssay Description:Displacement of [3H]naltrindole from human delta opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  5.20nMAssay Description:Displacement of [3H]naltrindole from delta opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2012
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  8.30nMAssay Description:Displacement of [3H]naltrindole from Opioid receptor delta 1 of guinea pig brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Rensselaer Polytechnic Institute

Curated by ChEMBL
LigandPNGBDBM50097579(8-CAC | CHEMBL58646 | (6S,11R)-3-Cyclopropylmethyl...)
Affinity DataKi:  8.30nMAssay Description:Binding affinity was determined towards Opioid receptor delta 1 using [3H]naltrindole as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed