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Target
Capsid protein
Ligand
BDBM50278716
Substrate
n/a
Meas. Tech.
ChEMBL_1719182 (CHEMBL4134182)
IC50
1200±n/a nM
Citation
 Li, X; Zhou, K; He, H; Zhou, Q; Sun, Y; Hou, L; Shen, L; Wang, X; Zhou, Y; Gong, Z; He, S; Jin, H; Gu, Z; Zhao, S; Zhang, L; Sun, C; Zheng, S; Cheng, Z; Zhu, Y; Zhang, M; Li, J; Chen, S Design, Synthesis, and Evaluation of Tetrahydropyrrolo[1,2- ACS Med Chem Lett 8:969-974 (2017) [PubMed]  Article 
Target
Name:
Capsid protein
Synonyms:
Core antigen
Type:
PROTEIN
Mol. Mass.:
26278.39
Organism:
Hepatitis B virus
Description:
ChEMBL_450484
Residue:
230
Sequence:
MIFVLGGCRHKLVCSPAPCNFFHLCLIISCSCPTVHASKLCLGWLWGMHIDPYKEFGASVELLSFLPSDFFPSIRDLLDTASALYREALESPEHCSPHHTALRQAILCWGELMNLATWVGSNLEDPASRELVVSYVNVNMGLKIRQLLWFHISCLTFGRETVLEYLVSFGVWIRTPPAYRPPNAPILSTLPETTVVRRRGRSPRRRTPSPRRRRSQSPRRRRSQSRESQC
  
Inhibitor
Name:
BDBM50278716
Synonyms:
CHEMBL4101961
Type:
Small organic molecule
Emp. Form.:
C20H20BrFN4O3S
Mol. Mass.:
495.365
SMILES:
COC(=O)C1=C(CN2CCOCC2)NC(=N[C@H]1c1ccc(F)cc1Br)c1nccs1 |r,c:4,15|
Structure:
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