BDBM50314077 5-(p-tolylthio)-9H-pyrimido[4,5-b]indole-2,4-diamine::CHEMBL1093100::US9422297, AAG-148-311

SMILES Cc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1

InChI Key InChIKey=IMNBYLUXBBXZIY-UHFFFAOYSA-N

Data  9 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50314077   

TargetThymidylate synthase(Human)
Duquesne University of The Holy Ghost

US Patent
LigandChemical structure of BindingDB Monomer ID 50314077BDBM50314077(5-(p-tolylthio)-9H-pyrimido[4,5-b]indole-2,4-diami...)
Affinity DataIC50: 390nMAssay Description:Inhibition of various kinase enzyme.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2017
Entry Details
US Patent

TargetThymidylate synthase(Human)
Duquesne University of The Holy Ghost

US Patent
LigandChemical structure of BindingDB Monomer ID 50314077BDBM50314077(5-(p-tolylthio)-9H-pyrimido[4,5-b]indole-2,4-diami...)
Affinity DataIC50: 390nMAssay Description:Inhibition of human thymidylate synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2012
Entry Details Article
PubMed
TargetThymidylate synthase(Escherichia coli (strain K12))
Duquesne University of The Holy Ghost

US Patent
LigandChemical structure of BindingDB Monomer ID 50314077BDBM50314077(5-(p-tolylthio)-9H-pyrimido[4,5-b]indole-2,4-diami...)
Affinity DataIC50: 2.60E+4nMAssay Description:Inhibition of various kinase enzyme.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/14/2017
Entry Details
US Patent

TargetDihydrofolate reductase(Human)
Duquesne University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50314077BDBM50314077(5-(p-tolylthio)-9H-pyrimido[4,5-b]indole-2,4-diami...)
Affinity DataIC50: 3.10E+4nMAssay Description:Inhibition of human DHFRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2012
Entry Details Article
PubMed