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Target
Inhibitor of nuclear factor kappa-B kinase subunit beta
Ligand
BDBM26090
Substrate
Biotinylated I-kappa-B-alpha Peptide Substrate
Meas. Tech.
IKK Inhibition Assay
pH
7.6±n/a
Temperature
298.15±n/a K
IC50
557±n/a nM
Citation
 Bonafoux, D; Bonar, S; Christine, L; Clare, M; Donnelly, A; Guzova, J; Kishore, N; Lennon, P; Libby, A; Mathialagan, S; McGhee, W; Rouw, S; Sommers, C; Tollefson, M; Tripp, C; Weier, R; Wolfson, S; Min, Y Inhibition of IKK-2 by 2-[(aminocarbonyl)amino]-5-acetylenyl-3-thiophenecarboxamides. Bioorg Med Chem Lett 15:2870-5 (2005) [PubMed]  Article 
Target
Name:
Inhibitor of nuclear factor kappa-B kinase subunit beta
Synonyms:
I-kappa-B Kinase 2 (IKK-beta) | I-kappa-B kinase 2 | I-kappa-B-kinase beta | I-kappa-B-kinase beta (IKKB) | IKBKB | IKK-B | IKK-beta | IKK2 | IKK2/IKK1 | IKKB | IKKB_HUMAN | Inhibitor of NF-kappa-B kinase alpha/beta | Inhibitor of nuclear factor kappa B kinase beta subunit | NFKBIKB | Nuclear factor NF-kappa-B inhibitor kinase beta
Type:
Serine/threonine-protein kinase
Mol. Mass.:
86554.39
Organism:
Homo sapiens (Human)
Description:
GST-tagged IKK-2 was expressed in High Five cells and purified.
Residue:
756
Sequence:
MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS
  
Inhibitor
Name:
BDBM26090
Synonyms:
5-acetylenyl-3-thiophenecarboxamide, 1n | N-(3-{2-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]ethynyl}phenyl)pyridine-3-carboxamide
Type:
Small organic molecule
Emp. Form.:
C20H15N5O3S
Mol. Mass.:
405.43
SMILES:
NC(=O)Nc1sc(cc1C(N)=O)C#Cc1cccc(NC(=O)c2cccnc2)c1
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
Biotinylated I-kappa-B-alpha Peptide Substrate
Synonyms:
n/a
Type:
Peptide
Mol. Mass.:
2684.39
Organism:
n/a
Description:
Peptide is derived from human I-kappa-B-alpha (residues 19-41).
Residue:
23
Sequence:
GLKKERLLDDRHDSGLDSMKDEE