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Target
NF-kappa-B essential modulator
Ligand
BDBM50587700
Substrate
n/a
Meas. Tech.
ChEMBL_2184657 (CHEMBL5096739)
Kd
190±n/a nM
Citation
 Hiesinger, K; Dar'in, D; Proschak, E; Krasavin, M Spirocyclic Scaffolds in Medicinal Chemistry. J Med Chem 64:150-183 (2021) [PubMed] 
Target
Name:
NF-kappa-B essential modulator
Synonyms:
FIP3 | IKBKG | Inhibitor of NF-kappa-B kinase (IKK) | NEMO | NEMO_HUMAN | NF-kappa-B essential modulator
Type:
PROTEIN
Mol. Mass.:
48190.12
Organism:
Homo sapiens (Human)
Description:
ChEMBL_84013
Residue:
419
Sequence:
MNRHLWKSQLCEMVQPSGGPAADQDVLGEESPLGKPAMLHLPSEQGAPETLQRCLEENQELRDAIRQSNQILRERCEELLHFQASQREEKEFLMCKFQEARKLVERLGLEKLDLKRQKEQALREVEHLKRCQQQMAEDKASVKAQVTSLLGELQESQSRLEAATKECQALEGRARAASEQARQLESEREALQQQHSVQVDQLRMQGQSVEAALRMERQAASEEKRKLAQLQVAYHQLFQEYDNHIKSSVVGSERKRGMQLEDLKQQLQQAEEALVAKQEVIDKLKEEAEQHKIVMETVPVLKAQADIYKADFQAERQAREKLAEKKELLQEQLEQLQREYSKLKASCQESARIEDMRKRHVEVSQAPLPPAPAYLSSPLALPSQRRSPPEEPPDFCCPKCQYQAPDMDTLQIHVMECIE
  
Inhibitor
Name:
BDBM50587700
Synonyms:
CHEMBL5171411
Type:
Small organic molecule
Emp. Form.:
C32H30N2O4
Mol. Mass.:
506.5916
SMILES:
[H][C@@]12C[C@@]3([C@H](c4ccc(C)cc4)[C@@]1([H])C=C(C=O)[C@H]([C@@H]2[N+]([O-])=O)c1ccc(C)cc1)C(=O)N(C)c1ccccc31 |r,t:16|
Structure:
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