BDBM50090053 1-(4-Bromo-phenyl)-6-isopropyl-1,6-dihydro-[1,3,5]triazine-2,4-diamine::CHEMBL94281

SMILES CC(C)C1N=C(N)N=C(N)N1c1ccc(Br)cc1

InChI Key InChIKey=MQLILUAGVVAVMX-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50090053   

TargetBifunctional dihydrofolate reductase-thymidylate synthase(malaria parasite P. falciparum)
National Center For Genetic Engineering and Biotechnology At Thailand

Curated by ChEMBL
LigandPNGBDBM50090053(1-(4-Bromo-phenyl)-6-isopropyl-1,6-dihydro-[1,3,5]...)
Affinity DataKi:  30nMAssay Description:Evaluated for inhibition constant (Ki wt) against Wild-type dihydrofolate reductase of Plasmodium falciparumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase [A16V,S108T](malaria parasite P. falciparum)
National Center For Genetic Engineering and Biotechnology At Thailand

Curated by ChEMBL
LigandPNGBDBM50090053(1-(4-Bromo-phenyl)-6-isopropyl-1,6-dihydro-[1,3,5]...)
Affinity DataKi:  1.20E+3nMAssay Description:Inhibition constant (Ki mut) against A16V+S108T Mutant DHFRs of Plasmodium falciparumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed