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Target
Matrix protein 2 [1-96]
Ligand
BDBM50494444
Substrate
n/a
Meas. Tech.
ChEMBL_1275613 (CHEMBL3090744)
IC50
13800±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:
BDBM50494444
Synonyms:
CHEMBL3088168
Type:
Small organic molecule
Emp. Form.:
C15H26ClN3
Mol. Mass.:
283.84
SMILES:
Cl.CCC12CC34CN(CC3(C1)CC2(CC)C4)C(N)=N |TLB:13:12:4:9.10,10:9:15:3.4,THB:11:9:4:15.12,11:12:4:9.10,8:9:4:15.12,(38.18,-45.8,;33.92,-47.33,;33.78,-48.86,;35.04,-49.75,;37.06,-50.27,;37.11,-51.7,;38.53,-52.05,;39.28,-50.16,;37.94,-51,;36.64,-50.72,;36.36,-49.5,;35.84,-52.07,;34.54,-51.5,;33,-51.46,;32.26,-50.11,;36.14,-52.75,;40.64,-49.37,;41.98,-50.14,;40.64,-47.83,)|
Structure:
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