Reaction Details Report a problem with these data
Target
14 kDa phosphohistidine phosphatase
Ligand
BDBM50186231
Substrate
n/a
Meas. Tech.
ChEMBL_2195294 (CHEMBL5107654)
IC50
18300±n/a nM
Citation
 Kim, HJ; Jung, H; Kim, S; Seo, JK; Kee, JM Identification of a Target Site for Covalent Inhibition of Protein Phosphohistidine Phosphatase 1. ACS Med Chem Lett 13:1911-1915 (2022) [PubMed] 
Target
Name:
14 kDa phosphohistidine phosphatase
Synonyms:
3.9.1.3 | PHP | PHP14 | PHP14_HUMAN | PHPT1 | Phosphohistidine phosphatase 1
Type:
PROTEIN
Mol. Mass.:
13830.85
Organism:
Homo sapiens
Description:
ChEMBL_120739
Residue:
125
Sequence:
MAVADLALIPDVDIDSDGVFKYVLIRVHSAPRSGAPAAESKEIVRGYKWAEYHADIYDKVSGDMQKQGCDCECLGGGRISHQSQDKKIHVYGYSMAYGPAQHAISTEKIKAKYPDYEVTWANDGY
  
Inhibitor
Name:
BDBM50186231
Synonyms:
(2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy)acetic acid | CHEMBL456 | ETHACRYNIC ACID | Edecrin | Etacrinic acid | Ethacrynate | Hydromedin | Methylenebutyrylphenoxyacetic acid | [2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid | jm5b01461, Compound 72
Type:
Small organic molecule
Emp. Form.:
C13H12Cl2O4
Mol. Mass.:
303.138
SMILES:
CCC(=C)C(=O)c1ccc(OCC(O)=O)c(Cl)c1Cl
Structure:
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