Target
Large envelope protein
Ligand
BDBM246836
Substrate
n/a
Meas. Tech.
HBsAg assay
Temperature
298.15±n/a K
IC50
20.0±n/a nM
Comments
extracted
Citation
 Han, XJiang, MWang, YYang, 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:
BDBM246836
Synonyms:
US10053461, 27 | trans-13-chloro-12-(3-methoxypropoxy)-2-oxo-2,5a,6,7,8,9,10,10a-octahydrocyclohepta[c]pyrido[2,1-a]isoquinoline-3-carboxylic acid
Type:
Small organic molecule
Emp. Form.:
C23H26ClNO5
Mol. Mass.:
431.909
SMILES:
COCCCOc1cc2[C@@H]3CCCCC[C@H]3n3cc(C(O)=O)c(=O)cc3-c2cc1Cl |r|
Structure:
Search PDB for entries with ligand similarity: