BDBM50024471 4-[(2-Amino-4-oxo-3,4,5,6,7,8-hexahydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-benzoic acid::CHEMBL22290

SMILES Nc1nc2CCC(CN(CC#C)c3ccc(cc3)C(O)=O)Cc2c(=O)[nH]1

InChI Key InChIKey=NLUYCHXZUFSXEE-UHFFFAOYSA-N

Data  2 IC50

  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 = 50024471   

TargetDihydrofolate reductase(Lactobacillus casei)
TBA

Curated by ChEMBL
LigandPNGBDBM50024471(4-[(2-Amino-4-oxo-3,4,5,6,7,8-hexahydro-quinazolin...)
Affinity DataIC50: 1.90E+5nMAssay Description:Evaluated for the inhibition of dihydrofolate reductase in Lactobacillus caseiMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetThymidylate synthase(Lactobacillus casei)
TBA

Curated by ChEMBL
LigandPNGBDBM50024471(4-[(2-Amino-4-oxo-3,4,5,6,7,8-hexahydro-quinazolin...)
Affinity DataIC50: 6.10E+5nMAssay Description:Evaluated for the inhibition of thymidylate synthase in Lactobacillus caseiMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed