BDBM50070033 CHEMBL3407791

SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Key InChIKey=IUNMMSQGPXQREV-OHBZYFOKSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50070033   

TargetThymidylate synthase(Homo sapiens (Human))
University Of California San Francisco

Curated by ChEMBL
LigandPNGBDBM50070033(CHEMBL3407791)
Affinity DataIC50:  8.10E+4nMAssay Description:Inhibition of wild-type His-tagged human thymidylate synthase after 1 hr by UV-visible spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Homo sapiens (Human))
University Of California San Francisco

Curated by ChEMBL
LigandPNGBDBM50070033(CHEMBL3407791)
Affinity DataIC50:  7.10E+4nMAssay Description:Inhibition of His-tagged human thymidylate synthase Y202A mutant after 1 hr by UV-visible spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Homo sapiens (Human))
University Of California San Francisco

Curated by ChEMBL
LigandPNGBDBM50070033(CHEMBL3407791)
Affinity DataIC50:  3.00E+5nMAssay Description:Inhibition of His-tagged human thymidylate synthase L198A mutant after 1 hr by UV-visible spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Homo sapiens (Human))
University Of California San Francisco

Curated by ChEMBL
LigandPNGBDBM50070033(CHEMBL3407791)
Affinity DataIC50:  5.60E+4nMAssay Description:Inhibition of His-tagged human thymidylate synthase K47A mutant after 1 hr by UV-visible spectrophotometryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed