Reaction Details Report a problem with these data
Target
Capsid scaffolding protein
Ligand
BDBM50143632
Substrate
n/a
Meas. Tech.
ChEMBL_77299 (CHEMBL687228)
IC50
6.9±n/a nM
Citation
 Gopalsamy, A; Lim, K; Ellingboe, JW; Mitsner, B; Nikitenko, A; Upeslacis, J; Mansour, TS; Olson, MW; Bebernitz, GA; Grinberg, D; Feld, B; Moy, FJ; O'Connell, J Design and syntheses of 1,6-naphthalene derivatives as selective HCMV protease inhibitors. J Med Chem 47:1893-9 (2004) [PubMed]  Article 
Target
Name:
Capsid scaffolding protein
Synonyms:
APNG | Assemblin | Assembly protein | Capsid protein P40 | Human cytomegalovirus protease (HCMV Pr) | Human herpes virus 5 capsid protein P40 | Protease precursor | SCAF_HCMVA | UL80 | pPR
Type:
PROTEIN
Mol. Mass.:
73854.16
Organism:
Human cytomegalovirus (strain AD169) (HHV-5) (Human herpesvirus 5)
Description:
ChEMBL_158958
Residue:
708
Sequence:
MTMDEQQSQAVAPVYVGGFLARYDQSPDEAELLLPRDVVEHWLHAQGQGQPSLSVALPLNINHDDTAVVGHVAAMQSVRDGLFCLGCVTSPRFLEIVRRASEKSELVSRGPVSPLQPDKVVEFLSGSYAGLSLSSRRCDDVEAATSLSGSETTPFKHVALCSVGRRRGTLAVYGRDPEWVTQRFPDLTAADRDGLRAQWQRCGSTAVDASGDPFRSDSYGLLGNSVDALYIRERLPKLRYDKQLVGVTERESYVKASVSPEAACDIKAASAERSGDSRSQAATPAAGARVPSSSPSPPVEPPSPVQPPALPASPSVLPAESPPSLSPSEPAEAASMSHPLSAAVPAATAPPGATVAGASPAVSSLAWPHDGVYLPKDAFFSLLGASRSAVPVMYPGAVAAPPSASPAPLPLPSYPASYGAPVVGYDQLAARHFADYVDPHYPGWGRRYEPAPSLHPSYPVPPPPSPAYYRRRDSPGGMDEPPSGWERYDGGHRGQSQKQHRHGGSGGHNKRRKETAAASSSSSDEDLSFPGEAEHGRARKRLKSHVNSDGGSGGHAGSNQQQQQRYDELRDAIHELKRDLFAARQSSTLLSAALPSAASSSPTTTTVCTPTGELTSGGGETPTALLSGGAKVAERAQAGVVNASCRLATASGSEAATAGPSTAGSSSCPASVVLAAAAAQAAAASQSPPKDMVDLNRRIFVAALNKLE
  
Inhibitor
Name:
BDBM50143632
Synonyms:
CHEMBL56307 | N-{5-[(E)-2-(3-Trifluoromethyl-phenyl)-vinyl]-naphthalen-2-yl}-terephthalamic acid
Type:
Small organic molecule
Emp. Form.:
C27H18F3NO3
Mol. Mass.:
461.4319
SMILES:
OC(=O)c1ccc(cc1)C(=O)Nc1ccc2c(\C=C\c3cccc(c3)C(F)(F)F)cccc2c1
Structure:
Search PDB for entries with ligand similarity: