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Target
Synaptic vesicular amine transporter
Ligand
BDBM611842
Substrate
n/a
Meas. Tech.
Methods for Determining VMAT2 Inhibitory Activity of a Compound
Ki
2.40±n/a nM
Citation
 Harriott, N; Pagano, N; Boon, BA Substituted pyrido[2,1-a]isoquinolines as VMAT2 inhibitors US Patent  US11718618 Publication Date 8/8/2023 
Target
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:
MALSELALVRWLQESRRSRKLILFIVFLALLLDNMLLTVVVPIIPSYLYSIKHEKNATEIQTARPVHTASISDSFQSIFSYYDNSTMVTGNATRDLTLHQTATQHMVTNASAVPSDCPSEDKDLLNENVQVGLLFASKATVQLITNPFIGLLTNRIGYPIPIFAGFCIMFVSTIMFAFSSSYAFLLIARSLQGIGSSCSSVAGMGMLASVYTDDEERGNVMGIALGGLAMGVLVGPPFGSVLYEFVGKTAPFLVLAALVLLDGAIQLFVLQPSRVQPESQKGTPLTTLLKDPYILIAAGSICFANMGIAMLEPALPIWMMETMCSRKWQLGVAFLPASISYLIGTNIFGILAHKMGRWLCALLGMIIVGVSILCIPFAKNIYGLIAPNFGVGFAIGMVDSSMMPIMGYLVDLRHVSVYGSVYAIADVAFCMGYAIGPSAGGAIAKAIGFPWLMTIIGIIDILFAPLCFFLRSPPAKEEKMAILMDHNCPIKTKMYTQNNIQSYPIGEDEESESD
  
Inhibitor
Name:
BDBM611842
Synonyms:
(2R,3R,11bR)-3-(2,2- dimethylpropyl)-10-methoxy- 9-(2,2,2-trifluoroethoxy)- 1H,2H,3H,4H,6H,7H,11bH- pyrido[2,1-a]isoquinolin-2-ol | US11718618, Compound 4-1
Type:
Small organic molecule
Emp. Form.:
C21H30F3NO3
Mol. Mass.:
401.463
SMILES:
COc1cc2[C@H]3C[C@@H](O)[C@H](CC(C)(C)C)CN3CCc2cc1OCC(F)(F)F |r|
Structure:
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