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Target
Matrix protein 2 [1-96]
Ligand
BDBM50494442
Substrate
n/a
Meas. Tech.
ChEMBL_1275613 (CHEMBL3090744)
IC50
290±n/a nM
Citation
 Rey-Carrizo, M; Torres, E; Ma, C; Barniol-Xicota, M; Wang, J; Wu, Y; Naesens, L; DeGrado, WF; Lamb, RA; Pinto, LH; Vázquez, S 3-Azatetracyclo[5.2.1.1(5,8).0(1,5)]undecane derivatives: from wild-type inhibitors of the M2 ion channel of influenza A virus to derivatives with potent activity against the V27A mutant. J Med Chem 56:9265-74 (2013) [PubMed]  Article 
Target
Name:
Matrix protein 2 [1-96]
Synonyms:
M | M2_I72A2 | Matrix protein 2
Type:
PROTEIN
Mol. Mass.:
11051.96
Organism:
Influenza A virus
Description:
ChEMBL_1453980
Residue:
96
Sequence:
MSLLTEVETPIRNEWGCRCNDSSDPLVVAASIIGILHLILWILDRLFFKCIYRFFEHGLKRGPSTEGVPESMREEYRKEQQSAVDADDSHFVSIEL
  
Inhibitor
Name:
BDBM50494442
Synonyms:
CHEMBL3088292
Type:
Small organic molecule
Emp. Form.:
C15H24ClN3
Mol. Mass.:
281.824
SMILES:
Cl.NC(=N)N1CC23CC45CC2(C1)CC4(C3)CCCC5 |TLB:15:13:7:10.9,11:10:7:13.14,THB:12:13:7:10.9,12:10:7:13.14,(50.7,-47.54,;53.17,-52.02,;51.8,-51.23,;51.8,-49.65,;50.4,-52.03,;49.04,-52.9,;47.7,-52.6,;47.41,-51.36,;45.66,-51.59,;48.14,-52.14,;48.19,-53.62,;49.64,-53.97,;47.19,-54.69,;45.6,-53.35,;46.88,-53.99,;44.15,-53.86,;42.87,-53.12,;42.95,-51.41,;44.34,-50.75,)|
Structure:
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