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Target
Adenosine kinase
Ligand
BDBM50241445
Substrate
n/a
Meas. Tech.
ChEMBL_491790 (CHEMBL937861)
Ki
28000±n/a nM
Citation
 Kim, YA; Sharon, A; Chu, CK; Rais, RH; Al Safarjalani, ON; Naguib, FN; el Kouni, MH Structure-activity relationships of 7-deaza-6-benzylthioinosine analogues as ligands of Toxoplasma gondii adenosine kinase. J Med Chem 51:3934-45 (2008) [PubMed]  Article 
Target
Name:
Adenosine kinase
Synonyms:
ADK_TOXGO | AK
Type:
PROTEIN
Mol. Mass.:
38353.04
Organism:
Toxoplasma gondii
Description:
ChEMBL_629062
Residue:
363
Sequence:
MAVDSSNSATGPMRVFAIGNPILDLVAEVPSSFLDEFFLKRGDATLATPEQMRIYSTLDQFNPTSLPGGSALNSVRVVQKLLRKPGSAGYMGAIGDDPRGQVLKELCDKEGLATRFMVAPGQSTGVCAVLINEKERTLCTHLGACGSFRLPEDWTTFASGALIFYATAYTLTATPKNALEVAGYAHGIPNAIFTLNLSAPFCVELYKDAMQSLLLHTNILFGNEEEFAHLAKVHNLVAAEKTALSTANKEHAVEVCTGALRLLTAGQNTGATKLVVMTRGHNPVIAAEQTADGTVVVHEVGVPVVAAEKIVDTNGAGDAFVGGFLYALSQGKTVKQCIMCGNACAQDVIQHVGFSLSFTSLPC
  
Inhibitor
Name:
BDBM50241445
Synonyms:
(2R,3R,4S,5R)-2-(4-(benzylthio)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)-tetrahydrofuran-3,4-diol | 4-Benzylthio-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine | CHEMBL410476
Type:
Small organic molecule
Emp. Form.:
C18H19N3O4S
Mol. Mass.:
373.426
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc2c(SCc3ccccc3)ncnc12 |r|
Structure:
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