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Target
Protein phosphatase methylesterase 1
Ligand
BDBM50400997
Substrate
n/a
Meas. Tech.
ChEMBL_879954 (CHEMBL2212403)
IC50
10800±n/a nM
Citation
 Bachovchin, DA; Zuhl, AM; Speers, AE; Wolfe, MR; Weerapana, E; Brown, SJ; Rosen, H; Cravatt, BF Discovery and optimization of sulfonyl acrylonitriles as selective, covalent inhibitors of protein phosphatase methylesterase-1. J Med Chem 54:5229-36 (2011) [PubMed]  Article 
Target
Name:
Protein phosphatase methylesterase 1
Synonyms:
PME1 | PPME1 | PPME1_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
42310.94
Organism:
Homo sapiens (Human)
Description:
gi_7706645
Residue:
386
Sequence:
MSALEKSMHLGRLPSRPPLPGSGGSQSGAKMRMGPGRKRDFSPVPWSQYFESMEDVEVENETGKDTFRVYKSGSEGPVLLLLHGGGHSALSWAVFTAAIISRVQCRIVALDLRSHGETKVKNPEDLSAETMAKDVGNVVEAMYGDLPPPIMLIGHSMGGAIAVHTASSNLVPSLLGLCMIDVVEGTAMDALNSMQNFLRGRPKTFKSLENAIEWSVKSGQIRNLESARVSMVGQVKQCEGITSPEGSKSIVEGIIEEEEEDEEGSESISKRKKEDDMETKKDHPYTWRIELAKTEKYWDGWFRGLSNLFLSCPIPKLLLLAGVDRLDKDLTIGQMQGKFQMQVLPQCGHAVHEDAPDKVAEAVATFLIRHRFAEPIGGFQCVFPGC
  
Inhibitor
Name:
BDBM50400997
Synonyms:
CHEMBL1521288
Type:
Small organic molecule
Emp. Form.:
C14H12N2O4S2
Mol. Mass.:
336.386
SMILES:
CS(=O)(=O)C(=C\c1cccn1S(=O)(=O)c1ccccc1)\C#N
Structure:
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