Reaction Details Report a problem with these data
Target
Large envelope protein
Ligand
BDBM540701
Substrate
n/a
Meas. Tech.
Test Method of EC50 of Anti HBV
EC50
5.00±n/a nM
Citation
 Liu, X; Ren, Q; Yan, G; Goldmann, S; Zhang, Y Dihydropyrimidine compounds and uses thereof in medicine US Patent  US11261190 Publication Date 3/1/2022 
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:
BDBM540701
Synonyms:
US11261190, Example 25
Type:
Small organic molecule
Emp. Form.:
C32H32ClFN6O5S
Mol. Mass.:
667.15
SMILES:
COC(=O)CCc1ccc(cc1)N1C[C@@H]2CN(CC3=C([C@@H](N=C(N3)c3nccs3)c3ccc(F)cc3Cl)C(=O)OC)CCN2C1=O |r,c:22,t:19|
Structure:
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