Reaction Details Report a problem with these data
Target
Ubiquitin-conjugating enzyme E2 N
Ligand
BDBM67694
Substrate
n/a
Meas. Tech.
Dose Response confirmation of uHTS for the identification of UBC13 Polyubiquitin Inhibitors via a TR-FRET Assay
IC50
3504±288 nM
Citation
 PubChem, PC Dose Response confirmation of uHTS for the identification of UBC13 Polyubiquitin Inhibitors via a TR-FRET Assay PubChem Bioassay (2011)[AID] 
Target
Name:
Ubiquitin-conjugating enzyme E2 N
Synonyms:
BLU | UBE2N | UBE2N_HUMAN | ubiquitin-conjugating enzyme E2 N
Type:
PROTEIN
Mol. Mass.:
17137.61
Organism:
Homo sapiens (Human)
Description:
EBI_101440
Residue:
152
Sequence:
MAGLPRRIIKETQRLLAEPVPGIKAEPDESNARYFHVVIAGPQDSPFEGGTFKLELFLPEEYPMAAPKVRFMTKIYHPNVDKLGRICLDILKDKWSPALQIRTVLLSIQALLSAPNPDDPLANDVAEQWKTNEAQAIETARAWTRLYAMNNI
  
Inhibitor
Name:
BDBM67694
Synonyms:
MLS002232301 | N'-[4-[[5-[3-[[(E)-4-(dimethylamino)-1-oxobut-2-enyl]amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3-fluorophenyl]-N-(4-fluorophenyl)propanediamide | N'-[4-[[5-[3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3-fluoranyl-phenyl]-N-(4-fluorophenyl)propanediamide | N'-[4-[[5-[3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3-fluoro-phenyl]-N-(4-fluorophenyl)malonamide | N'-[4-[[5-[3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3-fluorophenyl]-N-(4-fluorophenyl)propanediamide | SMR001307855 | cid_42601361
Type:
Small organic molecule
Emp. Form.:
C33H29F2N7O4
Mol. Mass.:
625.6247
SMILES:
CN(C)C\C=C\C(=O)Nc1cccc(c1)-c1c[nH]c2ncnc(Oc3ccc(NC(=O)CC(=O)Nc4ccc(F)cc4)cc3F)c12
Structure:
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