Target
Adenosine kinase
Ligand
BDBM50252013
Substrate
n/a
Meas. Tech.
ChEMBL_491790 (CHEMBL937861)
Ki
5200±n/a nM
Citation
 Kim, YASharon, AChu, CKRais, RHAl Safarjalani, ONNaguib, FNel 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:
BDBM50252013
Synonyms:
4-[(4-Cyanobenzyl)thio]-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine | CHEMBL479811
Type:
Small organic molecule
Emp. Form.:
C19H18N4O4S
Mol. Mass.:
398.436
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc2c(SCc3ccc(cc3)C#N)ncnc12 |r|
Structure:
Search PDB for entries with ligand similarity: