Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetDihydrofolate reductase
LigandBDBM50100259
Substrate/Competitorn/a
Meas. Tech.ChEMBL_55111 (CHEMBL665438)
IC50 56000±n/a nM
Citation Gangjee, AVidwans, AElzein, EMcGuire, JJQueener, SFKisliuk, RL Synthesis, antifolate, and antitumor activities of classical and nonclassical 2-amino-4-oxo-5-substituted-pyrrolo[2,3-d]pyrimidines. J Med Chem44:1993-2003 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Dihydrofolate reductase
Name:Dihydrofolate reductase
Synonyms:DYR_RAT | Dhfr | Dihydrofolate reductase (DHFR) | Dihydrofolate reductase; P. carinii vs rat | Tetrahydrofolate dehydrogenase
Type:Enzyme
Mol. Mass.:21638.84
Organism:Rattus norvegicus (rat)
Description:n/a
Residue:187
Sequence:
MVRPLNCIVAVSQNMGIGKNGDLPWPLLRNEFKYFQRMTTTSSVEGKQNLVIMGRKTWFS
IPEKNRPLKDRINIVLSRELKEPPQGAHFLAKSLDDALKLIEQPELASKVDMVWVVGGSS
VYQEAMNQPGHLRLFVTRIMQEFESDTFFPEIDLEKYKLLPEYPGVLSEIQEEKGIKYKF
EVYEKKD
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50100259
n/a
NameBDBM50100259
Synonyms:2-Amino-5-{[(2,5-dimethoxy-phenyl)-methyl-amino]-methyl}-3,7-dihydro-pyrrolo[2,3-d]pyrimidin-4-one | CHEMBL61927
TypeSmall organic molecule
Emp. Form.C16H19N5O3
Mol. Mass.329.3538
SMILESCOc1ccc(OC)c(c1)N(C)Cc1c[nH]c2nc(N)[nH]c(=O)c12
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: