BDBM364549 (4bR,6S,8aS,9R)-6-amino-11- (cyclopropylmethyl)-5,6,7,8,9,10- hexahydro- 9,4b-(epiminoethano)-8a,6- (epoxymethano)phenanthren-3-ol::US9862726, Compound 17

SMILES NC12CC[C@@]3(OC1)[C@H]1Cc4ccc(O)cc4[C@@]3(CCN1CC1CC1)C2

InChI Key InChIKey=CNWWHUKTYPEEDU-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 364549   

TargetKappa-type opioid receptor(Human)
Purdue Pharma

US Patent
LigandPNGBDBM364549(US9862726, Compound 17 | (4bR,6S,8aS,9R)-6-amino-1...)
Affinity DataKi:  0.0960nMAssay Description:Radioligand dose displacement assays used 0.4 nM [3H]-U69,593 (GE Healthcare, Piscataway, N.J.; 40 Ci/mmole) with 15 μg membrane protein (recomb...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2019
Entry Details
US Patent

TargetMu-type opioid receptor(Human)
Purdue Pharma

US Patent
LigandPNGBDBM364549(US9862726, Compound 17 | (4bR,6S,8aS,9R)-6-amino-1...)
Affinity DataKi:  0.790nMAssay Description:Radioligand dose-displacement binding assays for μ-opioid receptors used 0.3 nM [3H]-diprenorphine (Perkin Elmer, Shelton, Conn.), with 5 mg mem...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2019
Entry Details
US Patent