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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-crystallin A chain'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-crystallin A chain


(Homo sapiens)
BDBM50459236
PNG
(CHEMBL4203007)
Show SMILES C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
Show InChI InChI=1S/C30H52O2/c1-20(10-9-16-26(2,3)32)21-13-18-30(8)23-11-12-24-27(4,5)25(31)15-17-28(24,6)22(23)14-19-29(21,30)7/h20-21,24-25,31-32H,9-19H2,1-8H3/t20-,21-,24+,25+,28-,29-,30+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 36n/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Induction of redissolving of aggregated alpha-crystallin A Y118D mutant (unknown origin) incubated for 24 hrs by ThT-fluorescence based assay


J Med Chem 61: 8693-8706 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00705
BindingDB Entry DOI: 10.7270/Q2JQ13NZ
More data for this
Ligand-Target Pair