BDBM50017762 2-(4-{[2-Amino-5-(2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro-pteridin-6-ylmethyl]-methyl-amino}-benzoylamino)-pentanedioic acid

SMILES CN(CC1CNc2nc(N)[nH]c(=O)c2N1Cc1c[nH]c(=O)[nH]c1=O)c1ccc(cc1)C(=O)NC(CCC([O-])=O)C([O-])=O

InChI Key InChIKey=VMMYIEJVPJGRNH-UHFFFAOYSA-L

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50017762   

TargetThymidylate synthase(Human)
University of Utah

Curated by ChEMBL
LigandPNGBDBM50017762(2-(4-{[2-Amino-5-(2,4-dioxo-1,2,3,4-tetrahydro-pyr...)
Affinity DataKi:  750nMAssay Description:Inhibition of compound against thymidylate synthetaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2012
Entry Details Article
PubMed