BDBM50014467 (S)-2-(4-(((2-isopropyl-4-oxo-3,4-dihydroquinazolin-6-yl)methyl)(prop-2-ynyl)amino)benzamido)pentanedioic acid::2-{4-[(2-Isopropyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-benzoylamino}-pentanedioic acid::CHEMBL102317

SMILES C#CCN(Cc1ccc2nc(C(C)C)[nH]c(=O)c2c1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1

InChI Key InChIKey=YYQFIQLTWZLQIO-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 = 50014467   

TargetThymidylate synthase(Human)
Meerut Institute of Engineering and Technology

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50014467BDBM50014467((S)-2-(4-(((2-isopropyl-4-oxo-3,4-dihydroquinazoli...)
Affinity DataIC50: 617nMAssay Description:Inhibition of thymidylate synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2013
Entry Details Article
PubMed
TargetThymidylate synthase(Mouse)
Ici Pharmaceuticals Group

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50014467BDBM50014467((S)-2-(4-(((2-isopropyl-4-oxo-3,4-dihydroquinazoli...)
Affinity DataIC50: 620nMAssay Description:Binding affinity against Thymidylate synthase was measured in vitroMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed