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Target
Genome polyprotein
Ligand
BDBM50459259
Substrate
n/a
Meas. Tech.
ChEMBL_1765974 (CHEMBL4201221)
EC50
500±n/a nM
Citation
 Da Costa, L; Scheers, E; Coluccia, A; Casulli, A; Roche, M; Di Giorgio, C; Neyts, J; Terme, T; Cirilli, R; La Regina, G; Silvestri, R; Mirabelli, C; Vanelle, P Structure-Based Drug Design of Potent Pyrazole Derivatives against Rhinovirus Replication. J Med Chem 61:8402-8416 (2018) [PubMed]  Article 
Target
Name:
Genome polyprotein
Synonyms:
VP1 capsid protein
Type:
PROTEIN
Mol. Mass.:
32599.37
Organism:
Human rhinovirus 1A
Description:
ChEMBL_116925
Residue:
287
Sequence:
NPVENYIDEVLNEVLVVPNIKESHHTTSNSAPLLDAAETGHTSNVQPEDAIETRYVITSQTRDEMSIESFLGRSGCVHISRIKVDYTDYNGQDINFTKWKITLQEMAQIRRKFELFTYVRFDSEITLVPCIAGRGDDIGHIVMQYMYVPPGAPIPSKRNDFSWQSGTNMSIFWQHGQPFPRFSLPFLSIASAYYMFYDGYDGDNTSSKYGSVVTNDMGTICSRIVTEKQKHSVVITTHIYHKAKHTKAWCPRPPRAVPYTHSHVTNYMPETGDVTTAIVRRNTITTA
  
Inhibitor
Name:
BDBM50459259
Synonyms:
CHEMBL4206751
Type:
Small organic molecule
Emp. Form.:
C22H18F3N5O3
Mol. Mass.:
457.4052
SMILES:
Cn1nc(cc1-c1ccc(CC(O)c2ccc(cc2)-n2cccn2)c(c1)[N+]([O-])=O)C(F)(F)F
Structure:
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