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Target
Alpha-crystallin A chain
Ligand
BDBM50221789
Substrate
n/a
Meas. Tech.
ChEMBL_2263557
IC50
418000±n/a nM
Citation
 Twum, K; Bhattacharjee, A; Laryea, ET; Esposto, J; Omolloh, G; Mortensen, S; Jaradi, M; Stock, NL; Schileru, N; Elias, B; Pszenica, E; McCormick, TM; Martic, S; Beyeh, NK Functionalized resorcinarenes effectively disrupt the aggregation of ?A66-80 crystallin peptide related to cataracts. RSC Med Chem 12:2022-2030 (2021) [PubMed]  Article 
Target
Name:
Alpha-crystallin A chain
Synonyms:
Alpha-crystallin A(1-162) | Alpha-crystallin A(1-168) | Alpha-crystallin A(1-172) | CRYA1 | CRYAA | CRYAA_HUMAN | HSPB4 | Heat shock protein beta-4
Type:
PROTEIN
Mol. Mass.:
19907.56
Organism:
Homo sapiens
Description:
ChEMBL_118410
Residue:
173
Sequence:
MDVTIQHPWFKRTLGPFYPSRLFDQFFGEGLFEYDLLPFLSSTISPYYRQSLFRTVLDSGISEVRSDRDKFVIFLDVKHFSPEDLTVKVQDDFVEIHGKHNERQDDHGYISREFHRRYRLPSNVDQSALSCSLSADGMLTFCGPKIQTGLDATHAERAIPVSREEKPTSAPSS
  
Inhibitor
Name:
BDBM50221789
Synonyms:
CHEMBL5270342
Type:
Small organic molecule
Emp. Form.:
C72H90Cl4N4O12
Mol. Mass.:
1345.317
SMILES:
Cl.Cl.Cl.Cl.OCCCCc1cc(C(CCCO)c2cc(C(CCCO)c3cc(C(CCCO)c4ccc(O)c(CNCc5ccccc5)c4O)c(O)c(CNCc4ccccc4)c3O)c(O)c(CNCc3ccccc3)c2O)c(O)c(CNCc2ccccc2)c1O
Structure:
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