BDBM494161 US10988481, Compound 15

SMILES O=C(N[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C2CC2)C1O5)c1cccc2cc[nH]c12

InChI Key InChIKey=AGEDNIMOIFKPSV-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 494161   

TargetMu-type opioid receptor(Human)
Virginia Commonwealth University

US Patent
LigandChemical structure of BindingDB Monomer ID 494161BDBM494161(US10988481, Compound 15)
Affinity DataKi:  0.188nMAssay Description:The competition binding assay was conducted to determine the affinity and selectivity of the synthesized compounds to MOR over KOR and DOR. The Kd an...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/1/2021
Entry Details
US Patent

TargetKappa-type opioid receptor(Human)
Virginia Commonwealth University

US Patent
LigandChemical structure of BindingDB Monomer ID 494161BDBM494161(US10988481, Compound 15)
Affinity DataKi:  0.520nMAssay Description:The competition binding assay was conducted to determine the affinity and selectivity of the synthesized compounds to MOR over KOR and DOR. The Kd an...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/1/2021
Entry Details
US Patent

TargetDelta-type opioid receptor(Human)
Virginia Commonwealth University

US Patent
LigandChemical structure of BindingDB Monomer ID 494161BDBM494161(US10988481, Compound 15)
Affinity DataKi:  30.4nMAssay Description:The competition binding assay was conducted to determine the affinity and selectivity of the synthesized compounds to MOR over KOR and DOR. The Kd an...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/1/2021
Entry Details
US Patent