Reaction Details Report a problem with these data
Target
Phosphoethanolamine/phosphocholine phosphatase
Ligand
BDBM47034
Substrate
n/a
Meas. Tech.
SAR assay for compounds that inhibit PHOSPHO1
IC50
2590±n/a nM
Citation
 PubChem, PC SAR assay for compounds that inhibit PHOSPHO1 PubChem Bioassay (2010)[AID] 
Target
Name:
Phosphoethanolamine/phosphocholine phosphatase
Synonyms:
PHOP1_HUMAN | PHOSPHO1 | phosphatase, orphan 1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
29718.09
Organism:
Homo sapiens (Human)
Description:
Q8TCT1
Residue:
267
Sequence:
MSGCFPVSGLRCLSRDGRMAAQGAPRFLLTFDFDETIVDENSDDSIVRAAPGQRLPESLRATYREGFYNEYMQRVFKYLGEQGVRPRDLSAIYEAIPLSPGMSDLLQFVAKQGACFEVILISDANTFGVESSLRAAGHHSLFRRILSNPSGPDARGLLALRPFHTHSCARCPANMCKHKVLSDYLRERAHDGVHFERLFYVGDGANDFCPMGLLAGGDVAFPRRGYPMHRLIQEAQKAEPSSFRASVVPWETAADVRLHLQQVLKSC
  
Inhibitor
Name:
BDBM47034
Synonyms:
2,3-diphenyl-N-(phenylmethyl)-1,2,4-thiadiazol-2-ium-5-amine;hydrobromide | MLS-0390886.0001 | N-benzyl-2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-amine;hydrobromide | benzyl-(2,3-diphenyl-1,2,4-thiadiazol-2-ium-5-yl)amine;hydrobromide | cid_25181255
Type:
Small organic molecule
Emp. Form.:
C21H18N3S
Mol. Mass.:
344.452
SMILES:
C(Nc1nc(-c2ccccc2)[n+](s1)-c1ccccc1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: