null

SMILES [H][C@@]12C[C@]([H])(C(=C/OC)\C(=O)OC)[C@]([H])(CC)CN1CC[C@]21Nc2cccc(OC)c2C1=O

InChI Key InChIKey=BAEJBRCYKACTAA-WGUOAFTMSA-N

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50474150   

TargetKappa-type opioid receptor(Mus musculus (Mouse))
Memorial Sloan Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataKi:  24nMAssay Description:Displacement of [125I]-IBNtxA from mouse kappa opioid receptor-1 expressed in CHO cell membranes incubated for 90 minsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1P2HPubMed
TargetKappa-type opioid receptor(Cavia porcellus (domestic guinea pig))
Chiba University

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataKi:  79nMAssay Description:Binding affinity using guinea pig brain membrane preparations, towards Opioid receptor kappa 1 using [3H]- U-69,593 as radioligandMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WS8X0TPubMed
TargetKappa-type opioid receptor(Homo sapiens (Human))
Temple University School of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataKi:  79nMAssay Description:Binding affinity to kappa opioid receptor (unknown origin)More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FT8PZSPubMed
TargetKappa-type opioid receptor(Homo sapiens (Human))
Temple University School of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataIC50: 132nMAssay Description:Inhibition of kappa opioid receptor (unknown origin) in presence of DAMGO by [35S]-GTPgammaS binding assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2668HN9PubMed
TargetKappa-type opioid receptor(Homo sapiens (Human))
Temple University School of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataIC50: 132nMAssay Description:Inhibition of kappa opioid receptor (unknown origin) in presence of DPDPE by [35S]-GTPgammaS binding assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2668HN9PubMed
TargetKappa-type opioid receptor(Homo sapiens (Human))
Temple University School of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataEC50:  1.70nMAssay Description:Inhibition of kappa opioid receptor (unknown origin) in presence of DAMGO by [35S]-GTPgammaS binding assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2668HN9PubMed
TargetKappa-type opioid receptor(Homo sapiens (Human))
Temple University School of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataEC50:  1.70nMAssay Description:Inhibition of kappa opioid receptor (unknown origin) in presence of DPDPE by [35S]-GTPgammaS binding assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2668HN9PubMed
TargetKappa-type opioid receptor(Mus musculus (Mouse))
Memorial Sloan Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM50474150(CHEMBL58362)copy SMILEScopy InChI
Affinity DataIC50: 31nMAssay Description:Antagonist activity at mouse kappa opioid receptor-1 expressed in CHO cell membranes assessed as inhibition of U50,488H-induced [35S]GTPgammaS bindin...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q27H1P2HPubMed