Target
Dihydrofolate reductase
Ligand
BDBM50138691
Substrate
n/a
Meas. Tech.
ChEBML_54926
Ki
120±n/a nM
Citation
 Selassie, CDFang, ZXLi, RLHansch, CDebnath, GKlein, TELangridge, RKaufman, BT On the structure selectivity problem in drug design. A comparative study of benzylpyrimidine inhibition of vertebrate and bacterial dihydrofolate reductase via molecular graphics and quantitative structure-activity relationships. J Med Chem 32:1895-905 (1989) [PubMed]  Article 
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:
BDBM50138691
Synonyms:
5-(3,4-Dimethoxy-benzyl)-pyrimidine-2,4-diamine | CHEMBL19633 | Diaveridine
Type:
Small organic molecule
Emp. Form.:
C13H16N4O2
Mol. Mass.:
260.2917
SMILES:
COc1ccc(Cc2cnc(N)nc2N)cc1OC
Structure:
Search PDB for entries with ligand similarity: