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Target
Large envelope protein
Ligand
BDBM246844
Substrate
n/a
Meas. Tech.
HBsAg assay
Temperature
298.15±n/a K
IC50
110±n/a nM
Comments
extracted
Citation
 Han, X; Jiang, M; Wang, Y; Yang, S Tetracyclic 4-oxo-pyridine-3-carboxylic acid derivatives for the treatment and prophylaxis of hepatitis B virus infection US Patent  US10053461 Publication Date 8/21/2018 
Target
Name:
Large envelope protein
Synonyms:
HBSAG_HBVD3 | S
Type:
n/a
Mol. Mass.:
42772.52
Organism:
Hepatitis B virus
Description:
P03138
Residue:
389
Sequence:
MGQNLSTSNPLGFFPDHQLDPAFRANTANPDWDFNPNKDTWPDANKVGAGAFGLGFTPPHGGLLGWSPQAQGILQTLPANPPPASTNRQSGRQPTPLSPPLRNTHPQAMQWNSTTFHQTLQDPRVRGLYFPAGGSSSGTVNPVLTTASPLSSIFSRIGDPALNMENITSGFLGPLLVLQAGFFLLTRILTIPQSLDSWWTSLNFLGGTTVCLGQNSQSPTSNHSPTSCPPTCPGYRWMCLRRFIIFLFILLLCLIFLLVLLDYQGMLPVCPLIPGSSTTSTGPCRTCMTTAQGTSMYPSCCCTKPSDGNCTCIPIPSSWAFGKFLWEWASARFSWLSLLVPFVQWFVGLSPTVWLSVIWMMWYWGPSLYSILSPFLPLLPIFFCLWVYI
  
Inhibitor
Name:
BDBM246844
Synonyms:
Trans-11-methoxy-12-(3-methoxypropoxy)-8-oxo-1,3,4,4a,8,13b-hexahydropyrido[2,1-a]thiopyrano[4,3-c]isoquinoline-7-carboxylic acid | US10053461, 35
Type:
Small organic molecule
Emp. Form.:
C22H25NO6S
Mol. Mass.:
431.502
SMILES:
COCCCOc1cc2[C@H]3CSCC[C@@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1OC |r|
Structure:
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