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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Synaptic vesicular amine transporter' and Ligand = 'BDBM50320384'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Synaptic vesicular amine transporter


(Rattus norvegicus (Rat))
BDBM50320384
PNG
(CHEMBL1084838 | cis-4,4'-(2,2'-(1-methylpiperidine...)
Show SMILES CN1[C@@H](CCc2ccncc2)CCC[C@H]1CCc1ccncc1 |r|
Show InChI InChI=1S/C20H27N3/c1-23-19(7-5-17-9-13-21-14-10-17)3-2-4-20(23)8-6-18-11-15-22-16-12-18/h9-16,19-20H,2-8H2,1H3/t19-,20+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
5.23E+3n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of VMAT2-mediated [3H]dopamine uptake in rat synaptic vesicle membranes


Bioorg Med Chem Lett 20: 3584-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.117
BindingDB Entry DOI: 10.7270/Q2N879Z6
More data for this
Ligand-Target Pair
Synaptic vesicular amine transporter


(Rattus norvegicus (Rat))
BDBM50320384
PNG
(CHEMBL1084838 | cis-4,4'-(2,2'-(1-methylpiperidine...)
Show SMILES CN1[C@@H](CCc2ccncc2)CCC[C@H]1CCc1ccncc1 |r|
Show InChI InChI=1S/C20H27N3/c1-23-19(7-5-17-9-13-21-14-10-17)3-2-4-20(23)8-6-18-11-15-22-16-12-18/h9-16,19-20H,2-8H2,1H3/t19-,20+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
5.87E+3n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Displacement of [3H]DTBZ from VMAT2 in rat synaptic vesicle membranes after 30 mins by liquid scintillation counting


Bioorg Med Chem Lett 20: 3584-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.117
BindingDB Entry DOI: 10.7270/Q2N879Z6
More data for this
Ligand-Target Pair