Reaction Details Report a problem with these data
Target
Tegument protein VP16
Ligand
BDBM87300
Substrate
n/a
Meas. Tech.
Counterscreen for inhibitors of the Steroid Receptor Coactivator 3 (SRC3; NCOA3)
IC50
7964±n/a nM
Citation
 PubChem, PC Counterscreen for inhibitors of the Steroid Receptor Coactivator 3 (SRC3; NCOA3): Luminescence-based cell-based high throughput dose response assay to identify inhibitors of the Herpes Virus Virion Protein 16 (VP16) PubChem Bioassay (2012)[AID] 
Target
Name:
Tegument protein VP16
Synonyms:
Alpha trans-inducing protein (VP16) | VP16_HHV11 | transactivating tegument protein VP16
Type:
PROTEIN
Mol. Mass.:
54325.13
Organism:
Human herpesvirus 1 (strain 17) (HHV-1) (Human herpes simplex virus1)
Description:
EBI_100271
Residue:
490
Sequence:
MDLLVDELFADMNADGASPPPPRPAGGPKNTPAAPPLYATGRLSQAQLMPSPPMPVPPAALFNRLLDDLGFSAGPALCTMLDTWNEDLFSALPTNADLYRECKFLSTLPSDVVEWGDAYVPERTQIDIRAHGDVAFPTLPATRDGLGLYYEALSRFFHAELRAREESYRTVLANFCSALYRYLRASVRQLHRQAHMRGRDRDLGEMLRATIADRYYRETARLARVLFLHLYLFLTREILWAAYAEQMMRPDLFDCLCCDLESWRQLAGLFQPFMFVNGALTVRGVPIEARRLRELNHIREHLNLPLVRSAATEEPGAPLTTPPTLHGNQARASGYFMVLIRAKLDSYSSFTTSPSEAVMREHAYSRARTKNNYGSTIEGLLDLPDDDAPEEAGLAAPRLSFLPAGHTRRLSTAPPTDVSLGDELHLDGEDVAMAHADALDDFDLDMLGDGDSPGPGFTPHDSAPYGALDMADFEFEQMFTDALGIDEYGG
  
Inhibitor
Name:
BDBM87300
Synonyms:
(1-ethylimidazol-2-yl)methyl-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-methyl-amine | 1-(1-ethyl-1H-imidazol-2-yl)-N-{[3-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-N-methylmethanamine | MLS000734898 | N-[(1-ethyl-2-imidazolyl)methyl]-1-[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]-N-methylmethanamine | N-[(1-ethylimidazol-2-yl)methyl]-1-[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]-N-methyl-methanamine | N-[(1-ethylimidazol-2-yl)methyl]-1-[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]-N-methylmethanamine | SMR000315814 | cid_16191488
Type:
Small organic molecule
Emp. Form.:
C18H22FN5O
Mol. Mass.:
343.3986
SMILES:
CCn1ccnc1CN(C)Cc1c[nH]nc1-c1ccc(OC)c(F)c1
Structure:
Search PDB for entries with ligand similarity: