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Target
Acetyl-coenzyme A transporter 1
Ligand
BDBM47107
Substrate
n/a
Meas. Tech.
Binding Assay
IC50
1.6±n/a nM
Citation
 Maekawa, T; Igawa, H Fused ring compound and use thereof US Patent  US8592431 Publication Date 11/26/2013 
Target
Name:
Acetyl-coenzyme A transporter 1
Synonyms:
ACATN | ACATN_HUMAN | AT1 | Acetyl-coenzyme A transporter 1 (AT1) | SLC33A1
Type:
Enzyme
Mol. Mass.:
60911.27
Organism:
Homo sapiens (Human)
Description:
O00400
Residue:
549
Sequence:
MSPTISHKDSSRQRRPGNFSHSLDMKSGPLPPGGWDDSHLDSAGREGDREALLGDTGTGDFLKAPQSFRAELSSILLLLFLYVLQGIPLGLAGSIPLILQSKNVSYTDQAFFSFVFWPFSLKLLWAPLVDAVYVKNFGRRKSWLVPTQYILGLFMIYLSTQVDRLLGNTDDRTPDVIALTVAFFLFEFLAATQDIAVDGWALTMLSRENVGYASTCNSVGQTAGYFLGNVLFLALESADFCNKYLRFQPQPRGIVTLSDFLFFWGTVFLITTTLVALLKKENEVSVVKEETQGITDTYKLLFAIIKMPAVLTFCLLILTAKIGFSAADAVTGLKLVEEGVPKEHLALLAVPMVPLQIILPLIISKYTAGPQPLNTFYKAMPYRLLLGLEYALLVWWTPKVEHQGGFPIYYYIVVLLSYALHQVTVYSMYVSIMAFNAKVSDPLIGGTYMTLLNTVSNLGGNWPSTVALWLVDPLTVKECVGASNQNCRTPDAVELCKKLGGSCVTALDGYYVESIICVFIGFGWWFFLGPKFKKLQDEGSSSWKCKRNN
  
Inhibitor
Name:
BDBM47107
Synonyms:
US8592431, 155
Type:
n/a
Emp. Form.:
C35H42N6O5
Mol. Mass.:
626.7452
SMILES:
CCCc1c(Cc2ccc(c(C)c2)-c2ccccc2-c2noc(=O)[nH]2)c(=O)n(C2CCC(CC2)OCC(C)(C)O)c2nc(C)nn12 |(-4.24,2.37,;-2.67,3.21,;-1.33,2.44,;,3.21,;1.33,2.44,;1.33,.9,;,.13,;,-1.41,;-1.33,-2.18,;-2.67,-1.41,;-2.67,.13,;-4,.9,;-1.33,.9,;-4,-2.18,;-5.33,-1.41,;-6.67,-2.18,;-6.67,-3.72,;-5.33,-4.49,;-4,-3.72,;-2.67,-4.49,;-1.2,-4.01,;-.3,-5.26,;-1.2,-6.5,;-.43,-7.83,;-2.67,-6.03,;2.67,3.21,;4,2.44,;2.67,4.75,;4,5.52,;4,7.06,;5.33,7.83,;6.67,7.06,;6.67,5.52,;5.33,4.75,;8,7.83,;8,9.37,;9.34,10.14,;10.42,9.06,;10.88,10.14,;9.34,11.68,;1.33,5.52,;1.01,7.03,;-.52,7.19,;-1.29,8.53,;-1.14,5.79,;,4.75,)|
Structure:
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