Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50049614
Substrate
n/a
Meas. Tech.
ChEMBL_52843 (CHEMBL665047)
IC50
2000±n/a nM
Citation
 Gangjee, A; Zhu, Y; Queener, SF; Francom, P; Broom, AD Nonclassical 2,4-diamino-8-deazafolate analogues as inhibitors of dihydrofolate reductases from rat liver, Pneumocystis carinii, and Toxoplasma gondii. J Med Chem 39:1836-45 (1996) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
DFR1 | DYR_YEAST
Type:
PROTEIN
Mol. Mass.:
24263.24
Organism:
Baker's yeast
Description:
ChEMBL_52843
Residue:
211
Sequence:
MAGGKIPIVGIVACLQPEMGIGFRGGLPWRLPSEMKYFRQVTSLTKDPNKKNALIMGRKTWESIPPKFRPLPNRMNVIISRSFKDDFVHDKERSIVQSNSLANAIMNLESNFKEHLERIYVIGGGEVYSQIFSITDHWLITKINPLDKNATPAMDTFLDAKKLEEVFSEQDPAQLKEFLPPKVELPETDCDQRYSLEEKGYCFEFTLYNRK
  
Inhibitor
Name:
BDBM50049614
Synonyms:
6-[(3-Chloro-phenylamino)-methyl]-pyrido[3,2-d]pyrimidine-2,4-diamine | CHEMBL54618
Type:
Small organic molecule
Emp. Form.:
C14H13ClN6
Mol. Mass.:
300.746
SMILES:
Nc1nc(N)c2nc(CNc3cccc(Cl)c3)ccc2n1
Structure:
Search PDB for entries with ligand similarity: