Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetDihydrofolate reductase
LigandBDBM50033554
Substrate/Competitorn/a
Meas. Tech.ChEMBL_52992 (CHEMBL665261)
IC50 410±n/a nM
Citation Gangjee, AZaveri, NKothare, MQueener, SF Nonclassical 2,4-diamino-6-(aminomethyl)-5,6,7,8-tetrahydroquinazoline antifolates: synthesis and biological activities. J Med Chem38:3660-8 (1995) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Dihydrofolate reductase
Name:Dihydrofolate reductase
Synonyms:DYR_PNECA | Dihydrofolate Reductase (DHFR) | Dihydrofolate reductase | Dihydrofolate reductase; P. carinii vs rat | Tetrahydrofolate dehydrogenase
Type:Enzyme
Mol. Mass.:23891.29
Organism:Pneumocystis carinii
Description:n/a
Residue:206
Sequence:
MNQQKSLTLIVALTTSYGIGRSNSLPWKLKKEISYFKRVTSFVPTFDSFESMNVVLMGRK
TWESIPLQFRPLKGRINVVITRNESLDLGNGIHSAKSLDHALELLYRTYGSESSVQINRI
FVIGGAQLYKAAMDHPKLDRIMATIIYKDIHCDVFFPLKFRDKEWSSVWKKEKHSDLESW
VGTKVPHGKINEDGFDYEFEMWTRDL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50033554
n/a
NameBDBM50033554
Synonyms:6-[(2,5-Dichloro-phenylamino)-methyl]-5,6,7,8-tetrahydro-quinazoline-2,4-diamine | CHEMBL121319
TypeSmall organic molecule
Emp. Form.C15H17Cl2N5
Mol. Mass.338.235
SMILESNc1nc(N)c2CC(CNc3cc(Cl)ccc3Cl)CCc2n1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: