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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50448349   
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


(Homo sapiens (Human))
BDBM50448349
PNG
(CHEMBL3121449)
Show SMILES FC(F)(F)c1ccc2nc(c(CN(CC#C)c3ccc(Cl)cc3)nc2c1)-c1ccccc1
Show InChI InChI=1S/C25H17ClF3N3/c1-2-14-32(20-11-9-19(26)10-12-20)16-23-24(17-6-4-3-5-7-17)31-21-13-8-18(25(27,28)29)15-22(21)30-23/h1,3-13,15H,14,16H2
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Similars

Article
PubMed
4.00E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Sassari

Curated by ChEMBL


Assay Description
Competitive inhibition of human dihydrofolate reductase by spectrophotometry


Eur J Med Chem 75: 169-83 (2014)


Article DOI: 10.1016/j.ejmech.2014.01.048
BindingDB Entry DOI: 10.7270/Q2PR7XGH
More data for this
Ligand-Target Pair