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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dihydrofolate Reductase (DHFR)' and Ligand = 'BDBM50407499'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dihydrofolate Reductase (DHFR)


(Candida albicans)
BDBM50407499
PNG
(CHEMBL121303)
Show SMILES COc1ccccc1Sc1cccc2nc(N)nc(N)c12
Show InChI InChI=1S/C15H14N4OS/c1-20-10-6-2-3-7-11(10)21-12-8-4-5-9-13(12)14(16)19-15(17)18-9/h2-8H,1H3,(H4,16,17,18,19)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 100n/an/an/an/an/an/a



Burroughs Wellcome Company

Curated by ChEMBL


Assay Description
Inhibition of dihydrofolate reductase in Candida albicans (in vitro).


J Med Chem 38: 3608-16 (1995)


BindingDB Entry DOI: 10.7270/Q2V69KS6
More data for this
Ligand-Target Pair