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Target
Matrix protein 2 [1-96]
Ligand
BDBM50494443
Substrate
n/a
Meas. Tech.
ChEMBL_1275613 (CHEMBL3090744)
IC50
11400±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:
BDBM50494443
Synonyms:
CHEMBL3088163
Type:
Small organic molecule
Emp. Form.:
C13H22ClN3
Mol. Mass.:
255.787
SMILES:
Cl.CC12CC34CN(CC3(C1)CC2(C)C4)C(N)=N |TLB:9:8:13:2.3,12:11:3:8.9,THB:10:8:3:13.11,10:11:3:8.9,7:8:3:13.11,(13.43,-20.11,;7.65,-22.98,;8.69,-24.11,;10.85,-24.66,;10.91,-26.2,;12.42,-26.57,;13.22,-24.55,;11.79,-25.45,;10.4,-25.15,;10.1,-23.84,;9.54,-26.6,;8.15,-25.98,;6.69,-26.45,;9.86,-27.32,;14.68,-23.71,;16.11,-24.53,;14.68,-22.06,)|
Structure:
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