BDBM50105478 17-(2-phenoxyethyl)-(1R,9R,10R)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-5-ol::CHEMBL92774::MCL-127

SMILES Oc1ccc2c(C[C@@H]3[C@@H]4CCCCC24CCN3CCOc2ccccc2)c1

InChI Key InChIKey=ANPFDZVJMUWEGU-XAGPSQNTSA-N

Data  3 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50105478   

TargetMu-type opioid receptor(GUINEA PIG)
Harvard Medical School

Curated by ChEMBL
LigandPNGBDBM50105478(17-(2-phenoxyethyl)-(1R,9R,10R)-17-azatetracyclo[7...)
Show SMILES Oc1ccc2c(C[C@@H]3[C@@H]4CCCCC24CCN3CCOc2ccccc2)c1
Show InChI InChI=1S/C24H29NO2/c26-19-9-10-21-18(16-19)17-23-22-8-4-5-11-24(21,22)12-13-25(23)14-15-27-20-6-2-1-3-7-20/h1-3,6-7,9-10,16,22-23,26H,4-5,8,11-15,17H2/t22-,23+,24?/m0/s1
Affinity DataKi:  0.920nMAssay Description:Binding affinity towards Opioid receptor mu 1 in guinea pig brain membranes using [3H]DAMGO as radioligandMore data for this Ligand-Target Pair
TargetKappa-type opioid receptor(Cavia porcellus (domestic guinea pig))
Harvard Medical School

Curated by ChEMBL
LigandPNGBDBM50105478(17-(2-phenoxyethyl)-(1R,9R,10R)-17-azatetracyclo[7...)
Show SMILES Oc1ccc2c(C[C@@H]3[C@@H]4CCCCC24CCN3CCOc2ccccc2)c1
Show InChI InChI=1S/C24H29NO2/c26-19-9-10-21-18(16-19)17-23-22-8-4-5-11-24(21,22)12-13-25(23)14-15-27-20-6-2-1-3-7-20/h1-3,6-7,9-10,16,22-23,26H,4-5,8,11-15,17H2/t22-,23+,24?/m0/s1
Affinity DataKi:  15nMAssay Description:Binding affinity towards guinea pig Opioid receptor kappa 1 using radioligand [3H]U-69593More data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
Harvard Medical School

Curated by ChEMBL
LigandPNGBDBM50105478(17-(2-phenoxyethyl)-(1R,9R,10R)-17-azatetracyclo[7...)
Show SMILES Oc1ccc2c(C[C@@H]3[C@@H]4CCCCC24CCN3CCOc2ccccc2)c1
Show InChI InChI=1S/C24H29NO2/c26-19-9-10-21-18(16-19)17-23-22-8-4-5-11-24(21,22)12-13-25(23)14-15-27-20-6-2-1-3-7-20/h1-3,6-7,9-10,16,22-23,26H,4-5,8,11-15,17H2/t22-,23+,24?/m0/s1
Affinity DataKi:  33nMAssay Description:Binding affinity towards Opioid receptor delta 1 in guinea pig brain membranes using [3H]naltrindole as radioligandMore data for this Ligand-Target Pair