Reaction Details  Report a problem with these data
Target
Capsid scaffolding protein
Ligand
BDBM50075165
Substrate
n/a
Meas. Tech.
ChEBML_82457
IC50
350±n/a nM
Citation
 Jarvest, RL; Pinto, IL; Ashman, SM; Dabrowski, CE; Fernandez, AV; Jennings, LJ; Lavery, P; Tew, DG Inhibition of herpes proteases and antiviral activity of 2-substituted thieno[2,3-d]oxazinones. Bioorg Med Chem Lett 9:443-8 (1999) [PubMed]
Target
Name:
Capsid scaffolding protein
Synonyms:
Human herpesvirus 2 protease | SCAF_HHV2H | UL26
Type:
PROTEIN
Mol. Mass.:
66947.39
Organism:
Human herpesvirus 2 (strain HG52) (HHV-2) (Human herpes simplex virus2)
Description:
ChEMBL_82452
Residue:
637
Sequence:
MASAEMRERLEAPLPDRAVPIYVAGFLALYDSGDPGELALDPDTVRAALPPENPLPINVDHRARCEVGRVLAVVNDPRGPFFVGLIACVQLERVLETAASAAIFERRGPALSREERLLYLITNYLPSVSLSTKRRGDEVPPDRTLFAHVALCAIGRRLGTIVTYDTSLDAAIAPFRHLDPATREGVRREAAEAELALAGRTWAPGVEALTHTLLSTAVNNMMLRDRWSLVAERRRQAGIAGHTYLQASEKFKIWGAESAPAPERGYKTGAPGAMDTSPAASVPAPQVAVRARQVASSSSSSSFPAPADMNPVSASGAPAPPPPGDGSYLWIPASHYNQLVTGQSAPRHPPLTACGLPAAGTVAYGHPGAGPSPHYPPPPAHPYPGMLFAGPSPLEAQIAALVGAIAADRQAGGLPAAAGDHGIRGSAKRRRHEVEQPEYDCGRDEPDRDFPYYPGEARPEPRPVDSRRAARQASGPHETITALVGAVTSLQQELAHMRARTHAPYGPYPPVGPYHHPHADTETPAQPPRYPAKAVYLPPPHIAPPGPPLSGAVPPPSYPPVAVTPGPAPPLHQPSPAHAHPPPPPPGPTPPPAASLPQPEAPGAEAGALVNASSAAHVNVDTARAADLFVSQMMGSR
  
Inhibitor
Name:
BDBM50075165
Synonyms:
(E)-3-(3,5-Dimethoxy-phenyl)-N-[(S)-1-(5-methyl-4-oxo-4H-thieno[2,3-d][1,3]oxazin-2-yl)-ethyl]-acrylamide | CHEMBL138589
Type:
Small organic molecule
Emp. Form.:
C20H20N2O5S
Mol. Mass.:
400.448
SMILES:
COc1cc(OC)cc(\C=C\C(=O)N[C@@H](C)c2nc3scc(C)c3c(=O)o2)c1
Structure:
Search PDB for entries with ligand similarity: