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Reaction Details
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TargetSynaptic vesicular amine transporter
LigandBDBM611939
Substrate/Competitorn/a
Meas. Tech.Methods for Determining VMAT2 Inhibitory Activity of a Compound
Ki 0.290±n/a nM
Citation Harriott, NPagano, NBoon, BA Substituted pyrido[2,1-a]isoquinolines as VMAT2 inhibitors US Patent US11718618 Publication Date 8/8/2023
More Info.:Get all data from this article,  Assay Method
 
Synaptic vesicular amine transporter
Name:Synaptic vesicular amine transporter
Synonyms:Monoamine transporter | SLC18A2 | SVMT | Solute carrier family 18 member 2 | VAT2 | VMAT2 | VMAT2_HUMAN | Vesicular amine transporter 2
Type:PROTEIN
Mol. Mass.:55709.61
Organism:Homo sapiens (Human)
Description:ChEMBL_610810
Residue:514
Sequence:
MALSELALVRWLQESRRSRKLILFIVFLALLLDNMLLTVVVPIIPSYLYSIKHEKNATEI
QTARPVHTASISDSFQSIFSYYDNSTMVTGNATRDLTLHQTATQHMVTNASAVPSDCPSE
DKDLLNENVQVGLLFASKATVQLITNPFIGLLTNRIGYPIPIFAGFCIMFVSTIMFAFSS
SYAFLLIARSLQGIGSSCSSVAGMGMLASVYTDDEERGNVMGIALGGLAMGVLVGPPFGS
VLYEFVGKTAPFLVLAALVLLDGAIQLFVLQPSRVQPESQKGTPLTTLLKDPYILIAAGS
ICFANMGIAMLEPALPIWMMETMCSRKWQLGVAFLPASISYLIGTNIFGILAHKMGRWLC
ALLGMIIVGVSILCIPFAKNIYGLIAPNFGVGFAIGMVDSSMMPIMGYLVDLRHVSVYGS
VYAIADVAFCMGYAIGPSAGGAIAKAIGFPWLMTIIGIIDILFAPLCFFLRSPPAKEEKM
AILMDHNCPIKTKMYTQNNIQSYPIGEDEESESD
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM611939
n/a
NameBDBM611939
Synonyms:(2R,3R,11bR)-3-(2,2- dimethylpropyl)-9-{[(1R,2R)- 2-ethylcyclopropyl]methoxy}- 10-methoxy- 1H,2H,3H,4H,6H,7H,11bH- pyrido[2,1-a]isoquinolin-2-ol | US11718618, Compound 4-90
TypeSmall organic molecule
Emp. Form.C25H39NO3
Mol. Mass.401.5821
SMILESCC[C@@H]1C[C@H]1COc1cc2CCN3C[C@@H](CC(C)(C)C)[C@H](O)C[C@@H]3c2cc1OC |r|
Structure
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