Reaction Details |
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Target | NF-kappa-B essential modulator |
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Ligand | BDBM50587701 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2184657 (CHEMBL5096739) |
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Kd | 80±n/a nM |
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Citation | Hiesinger, K; Dar'in, D; Proschak, E; Krasavin, M Spirocyclic Scaffolds in Medicinal Chemistry. J Med Chem64:150-183 (2021) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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NF-kappa-B essential modulator |
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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: | MNRHLWKSQLCEMVQPSGGPAADQDVLGEESPLGKPAMLHLPSEQGAPETLQRCLEENQE
LRDAIRQSNQILRERCEELLHFQASQREEKEFLMCKFQEARKLVERLGLEKLDLKRQKEQ
ALREVEHLKRCQQQMAEDKASVKAQVTSLLGELQESQSRLEAATKECQALEGRARAASEQ
ARQLESEREALQQQHSVQVDQLRMQGQSVEAALRMERQAASEEKRKLAQLQVAYHQLFQE
YDNHIKSSVVGSERKRGMQLEDLKQQLQQAEEALVAKQEVIDKLKEEAEQHKIVMETVPV
LKAQADIYKADFQAERQAREKLAEKKELLQEQLEQLQREYSKLKASCQESARIEDMRKRH
VEVSQAPLPPAPAYLSSPLALPSQRRSPPEEPPDFCCPKCQYQAPDMDTLQIHVMECIE
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BDBM50587701 |
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n/a |
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Name | BDBM50587701 |
Synonyms: | CHEMBL5180326 |
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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