BDBM373530 US9902726, Compound 11

SMILES CN1CC[C@]23Cc4[nH]c(=O)c(cc4C[C@H]2[C@H]1Cc1ccc(O)cc31)S(C)(=O)=O

InChI Key InChIKey=VTAUHEGKMOJKSP-UHFFFAOYSA-N

Data  1 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 373530   

TargetKappa-type opioid receptor(Human)
Purdue Pharma

US Patent
LigandPNGBDBM373530(US9902726, Compound 11)
Affinity DataKi:  1.31E+4nMAssay Description:κ-Opioid: Radioligand dose displacement assays used 0.4 nM [3H]-U69,593 (GE Healthcare, Piscataway, N.J.; 40 Ci/mmole) with 15 μg membrane ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/21/2020
Entry Details
Go to US Patent