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Target
Nuclear factor erythroid 2-related factor 2
Ligand
BDBM50557134
Substrate
n/a
Meas. Tech.
ChEMBL_2057766 (CHEMBL4712767)
EC50
10.0±n/a nM
Citation
 Choi, JW; Kim, S; Yoo, JS; Kim, HJ; Kim, HJ; Kim, BE; Lee, EH; Lee, YS; Park, JH; Park, KD Development and optimization of halogenated vinyl sulfones as Nrf2 activators for the treatment of Parkinson's disease. Eur J Med Chem 212:0 (2021) [PubMed]  Article 
Target
Name:
Nuclear factor erythroid 2-related factor 2
Synonyms:
HEBP1 | Kelch-like ECH-associated protein 1 | NF-E2-related factor 2 | NF2L2_HUMAN | NFE2-related factor 2 | NFE2L2 | NRF2 | Nuclear factor erythroid 2-related factor 2 | Nuclear factor, erythroid derived 2, like 2
Type:
PROTEIN
Mol. Mass.:
67786.89
Organism:
Homo sapiens (Human)
Description:
ChEMBL_107924
Residue:
605
Sequence:
MMDLELPPPGLPSQQDMDLIDILWRQDIDLGVSREVFDFSQRRKEYELEKQKKLEKERQEQLQKEQEKAFFAQLQLDEETGEFLPIQPAQHIQSETSGSANYSQVAHIPKSDALYFDDCMQLLAQTFPFVDDNEVSSATFQSLVPDIPGHIESPVFIATNQAQSPETSVAQVAPVDLDGMQQDIEQVWEELLSIPELQCLNIENDKLVETTMVPSPEAKLTEVDNYHFYSSIPSMEKEVGNCSPHFLNAFEDSFSSILSTEDPNQLTVNSLNSDATVNTDFGDEFYSAFIAEPSISNSMPSPATLSHSLSELLNGPIDVSDLSLCKAFNQNHPESTAEFNDSDSGISLNTSPSVASPEHSVESSSYGDTLLGLSDSEVEELDSAPGSVKQNGPKTPVHSSGDMVQPLSPSQGQSTHVHDAQCENTPEKELPVSPGHRKTPFTKDKHSSRLEAHLTRDELRAKALHIPFPVEKIINLPVVDFNEMMSKEQFNEAQLALIRDIRRRGKNKVAAQNCRKRKLENIVELEQDLDHLKDEKEKLLKEKGENDKSLHLLKKQLSTLYLEVFSMLRDEDGKPYSPSEYSLQQTRDGNVFLVPKSKKPDVKKN
  
Inhibitor
Name:
BDBM50557134
Synonyms:
CHEMBL4776211
Type:
Small organic molecule
Emp. Form.:
C32H43NO4
Mol. Mass.:
505.6881
SMILES:
[H][C@@]12CCC(C)(C)C[C@@]1([H])[C@@]1([H])C(=O)C=C3[C@@](C)(CC[C@@]4([H])C(C)(C)C(=O)C(=C[C@]34C)C#N)[C@]1(C)C[C@@H]2C(=O)OC |r,c:15,28|
Structure:
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