Reaction Details  Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50041930
Substrate
n/a
Meas. Tech.
ChEMBL_53935 (CHEMBL667768)
IC50
7700±n/a nM
Citation
 Rosowsky, A; Mota, CE; Wright, JE; Freisheim, JH; Heusner, JJ; McCormack, JJ; Queener, SF 2,4-Diaminothieno[2,3-d]pyrimidine analogues of trimetrexate and piritrexim as potential inhibitors of Pneumocystis carinii and Toxoplasma gondii dihydrofolate reductase. J Med Chem 36:3103-12 (1993) [PubMed]
Target
Name:
Dihydrofolate reductase
Synonyms:
DYR_LACCA | dhfR | folA
Type:
PROTEIN
Mol. Mass.:
18437.08
Organism:
Lactobacillus casei
Description:
ChEMBL_1357878
Residue:
163
Sequence:
MTAFLWAQDRDGLIGKDGHLPWHLPDDLHYFRAQTVGKIMVVGRRTYESFPKRPLPERTNVVLTHQEDYQAQGAVVVHDVAAVFAYAKQHPDQELVIAGGAQIFTAFKDDVDTLLVTRLAGSFEGDTKMIPLNWDDFTKVSSRTVEDTNPALTHTYEVWQKKA
  
Inhibitor
Name:
BDBM50041930
Synonyms:
5-(4-Chloro-phenyl)-6-methyl-thieno[2,3-d]pyrimidine-2,4-diamine | CHEMBL107079
Type:
Small organic molecule
Emp. Form.:
C13H11ClN4S
Mol. Mass.:
290.771
SMILES:
Cc1sc2nc(N)nc(N)c2c1-c1ccc(Cl)cc1
Structure:
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