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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Synaptic vesicular amine transporter' and Ligand = 'BDBM50172082'   
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))
BDBM50172082
PNG
((4S)-2,4-dibenzyl-8-methyl-8-azabicyclo[3.2.1]oct-...)
Show SMILES CN1C2CCC1C(Cc1ccccc1)=C[C@@H]2Cc1ccccc1 |c:15,TLB:7:6:1:4.3,THB:16:15:1:4.3|
Show InChI InChI=1S/C22H25N/c1-23-21-12-13-22(23)20(15-18-10-6-3-7-11-18)16-19(21)14-17-8-4-2-5-9-17/h2-11,16,19,21-22H,12-15H2,1H3/t19-,21?,22?/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.30E+3n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition constant against [3H]-dihydrotetrabenazine binding to vesicular monoamine transporter-2 of rat synaptic vesicle membranes


Bioorg Med Chem Lett 15: 4463-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.032
BindingDB Entry DOI: 10.7270/Q2J38S3H
More data for this
Ligand-Target Pair
Synaptic vesicular amine transporter


(Rattus norvegicus (Rat))
BDBM50172082
PNG
((4S)-2,4-dibenzyl-8-methyl-8-azabicyclo[3.2.1]oct-...)
Show SMILES CN1C2CCC1C(Cc1ccccc1)=C[C@@H]2Cc1ccccc1 |c:15,TLB:7:6:1:4.3,THB:16:15:1:4.3|
Show InChI InChI=1S/C22H25N/c1-23-21-12-13-22(23)20(15-18-10-6-3-7-11-18)16-19(21)14-17-8-4-2-5-9-17/h2-11,16,19,21-22H,12-15H2,1H3/t19-,21?,22?/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition constant against [3H]-methyllycaconitine binding to vesicular monoamine transporter-2 of rat brain membranes


Bioorg Med Chem Lett 15: 4463-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.032
BindingDB Entry DOI: 10.7270/Q2J38S3H
More data for this
Ligand-Target Pair
Synaptic vesicular amine transporter


(Rattus norvegicus (Rat))
BDBM50172082
PNG
((4S)-2,4-dibenzyl-8-methyl-8-azabicyclo[3.2.1]oct-...)
Show SMILES CN1C2CCC1C(Cc1ccccc1)=C[C@@H]2Cc1ccccc1 |c:15,TLB:7:6:1:4.3,THB:16:15:1:4.3|
Show InChI InChI=1S/C22H25N/c1-23-21-12-13-22(23)20(15-18-10-6-3-7-11-18)16-19(21)14-17-8-4-2-5-9-17/h2-11,16,19,21-22H,12-15H2,1H3/t19-,21?,22?/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition constant against [3H]-nicotine binding to vesicular monoamine transporter-2 of rat brain membranes


Bioorg Med Chem Lett 15: 4463-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.032
BindingDB Entry DOI: 10.7270/Q2J38S3H
More data for this
Ligand-Target Pair