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Target
Inhibitor of nuclear factor kappa-B kinase subunit beta
Ligand
BDBM50366228
Substrate
n/a
Meas. Tech.
ChEMBL_806271 (CHEMBL1958917)
IC50
6600±n/a nM
Citation
 Sun, H; Chen, F; Wang, X; Liu, Z; Yang, Q; Zhang, X; Zhu, J; Qiang, L; Guo, Q; You, Q Studies on gambogic acid (IV): Exploring structure-activity relationship with I¿B kinase-beta (IKKß). Eur J Med Chem 51:110-23 (2012) [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:
BDBM50366228
Synonyms:
CHEMBL1958314
Type:
Small organic molecule
Emp. Form.:
C28H32O6
Mol. Mass.:
464.5501
SMILES:
[#6]-[#6](-[#6])=[#6]-[#6]-c1c(-[#8])cc(-[#8])c2-[#6](=O)-[#6]3=[#6]-[#6@@H]-4-[#6]-[#6@H]5C([#6])([#6])[#8][C@@]([#6]\[#6]=[#6](/[#6])-[#6])([#6]-4=O)[C@@]35[#8]-c12 |r,t:14,TLB:30:29:31:22.19,THB:15:16:31:22.19,19:18:14.15:23.29|
Structure:
Search PDB for entries with ligand similarity: