BDBM604957 US11667638, Example 116

SMILES C=Cc1cc2[C@@H]3CNCC(C3)Cn2c(=O)c1

InChI Key InChIKey=SSDSOAIBEZINDQ-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 604957   

TargetNeuronal acetylcholine receptor subunit alpha-4/beta-2(Human)
University of Bristol

US Patent
LigandPNGBDBM604957(US11667638, Example 116)
Affinity DataKi:  14.2nMAssay Description:The binding of a group of compounds mentioned above were tested for their affinity at different nAChR subtypes, specifically the α4β2, the ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2023
Entry Details
US Patent

TargetNeuronal acetylcholine receptor subunit alpha-3/beta-4(Human)
University of Bristol

US Patent
LigandPNGBDBM604957(US11667638, Example 116)
Affinity DataKi:  1.42E+3nMAssay Description:The binding of a group of compounds mentioned above were tested for their affinity at different nAChR subtypes, specifically the α4β2, the ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2023
Entry Details
US Patent

TargetNeuronal acetylcholine receptor subunit alpha-7(Human)
University of Bristol

US Patent
LigandPNGBDBM604957(US11667638, Example 116)
Affinity DataKi:  4.06E+4nMAssay Description:The binding of a group of compounds mentioned above were tested for their affinity at different nAChR subtypes, specifically the α4β2, the ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2023
Entry Details
US Patent