BDBM50243141 3beta-(4-Methylphenyl)-2beta-[30-(4-chlorobenzyl)isoxazol-5-yl]-tropane hydrochloride::CHEMBL486042

SMILES CN1C2CCC1[C@H]([C@H](C2)c1ccc(C)cc1)c1cc(Cc2ccc(Cl)cc2)no1

InChI Key InChIKey=IFMIAYDNKIHTBR-UHFFFAOYSA-N

Data  2 KI  1 IC50

  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 = 50243141   

TargetSodium-dependent dopamine transporter(Human)
Research Triangle Institute

Curated by ChEMBL
LigandPNGBDBM50243141(3beta-(4-Methylphenyl)-2beta-[30-(4-chlorobenzyl)i...)
Affinity DataIC50: 22.2nMAssay Description:Displacement of [3H]WIN-35428 from DATMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Research Triangle Institute

Curated by ChEMBL
LigandPNGBDBM50243141(3beta-(4-Methylphenyl)-2beta-[30-(4-chlorobenzyl)i...)
Affinity DataKi:  85nMAssay Description:Displacement of [3H]paroxetine from 5HTTMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetSodium-dependent noradrenaline transporter(Human)
Research Triangle Institute

Curated by ChEMBL
LigandPNGBDBM50243141(3beta-(4-Methylphenyl)-2beta-[30-(4-chlorobenzyl)i...)
Affinity DataKi:  840nMAssay Description:Displacement of [3H]nisoxetine from NETMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed