Reaction Details Report a problem with these data
Target
Envelope glycoprotein
Ligand
BDBM50247471
Substrate
n/a
Meas. Tech.
ChEMBL_1677814 (CHEMBL4027957)
Kd
1300000±n/a nM
Citation
 Ren, J; Zhao, Y; Fry, EE; Stuart, DI Target Identification and Mode of Action of Four Chemically Divergent Drugs against Ebolavirus Infection. J Med Chem 61:724-733 (2018) [PubMed]  Article 
Target
Name:
Envelope glycoprotein
Synonyms:
Envelope glycoprotein | GP | GP1 | GP1,2 | GP1,2-delta | GP2 | Shed GP | VGP_EBOZM
Type:
PROTEIN
Mol. Mass.:
74464.56
Organism:
Zaire ebolavirus (strain Mayinga-76) (ZEBOV) (Zaire Ebola virus)
Description:
ChEMBL_117434
Residue:
676
Sequence:
MGVTGILQLPRDRFKRTSFFLWVIILFQRTFSIPLGVIHNSTLQVSDVDKLVCRDKLSSTNQLRSVGLNLEGNGVATDVPSATKRWGFRSGVPPKVVNYEAGEWAENCYNLEIKKPDGSECLPAAPDGIRGFPRCRYVHKVSGTGPCAGDFAFHKEGAFFLYDRLASTVIYRGTTFAEGVVAFLILPQAKKDFFSSHPLREPVNATEDPSSGYYSTTIRYQATGFGTNETEYLFEVDNLTYVQLESRFTPQFLLQLNETIYTSGKRSNTTGKLIWKVNPEIDTTIGEWAFWETKKNLTRKIRSEELSFTVVSNGAKNISGQSPARTSSDPGTNTTTEDHKIMASENSSAMVQVHSQGREAAVSHLTTLATISTSPQSLTTKPGPDNSTHNTPVYKLDISEATQVEQHHRRTDNDSTASDTPSATTAAGPPKAENTNTSKSTDFLDPATTTSPQNHSETAGNNNTHHQDTGEESASSGKLGLITNTIAGVAGLITGGRRTRREAIVNAQPKCNPNLHYWTTQDEGAAIGLAWIPYFGPAAEGIYIEGLMHNQDGLICGLRQLANETTQALQLFLRATTELRTFSILNRKAIDFLLQRWGGTCHILGPDCCIEPHDWTKNITDKIDQIIHDFVDKTLPDQGDNDNWWTGWRQWIPAGIGVTGVIIAVIALFCICKFVF
  
Inhibitor
Name:
BDBM50247471
Synonyms:
CHEMBL558805
Type:
Small organic molecule
Emp. Form.:
C21H25NO
Mol. Mass.:
307.4293
SMILES:
[H][C@@]12CC[C@]([H])(CC(C1)OC(c1ccccc1)c1ccccc1)N2C |r,@@:7,TLB:9:7:23:2.3|
Structure:
Search PDB for entries with ligand similarity: