BDBM47584 (E)-2-(4-bromobenzoyl)-3-[4-(diethylamino)phenyl]acrylonitrile::(E)-2-(4-bromobenzoyl)-3-[4-(diethylamino)phenyl]prop-2-enenitrile::(E)-2-(4-bromophenyl)carbonyl-3-[4-(diethylamino)phenyl]prop-2-enenitrile::(E)-2-[(4-bromophenyl)-oxomethyl]-3-[4-(diethylamino)phenyl]-2-propenenitrile::MLS000576501::SMR000185885::cid_5333607
SMILES: CCN(CC)c1ccc(\C=C(/C#N)C(=O)c2ccc(Br)cc2)cc1
InChI Key: InChIKey=PYMMTFMRJFLXGP-GHRIWEEISA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BZLF2 (Human herpesvirus 4 type 2) | BDBM47584![]() ((E)-2-(4-bromobenzoyl)-3-[4-(diethylamino)phenyl]a...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet ![]() | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | 3.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay | Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2057DCW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
glutathione S-transferase (Homo sapiens (Human)) | BDBM47584![]() ((E)-2-(4-bromobenzoyl)-3-[4-(diethylamino)phenyl]a...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-re... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2ZC8184 | |||||||||||
More data for this Ligand-Target Pair |