BDBM50120979 2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-anthracen-6-ylmethyl)-benzoylamino]-pentanedioic acid::CHEMBL422316

SMILES Nc1nc(N)c2cc3CN(Cc4ccc(cc4)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CCc3nc2n1

InChI Key InChIKey=GAYYBAJBQWLHKS-UHFFFAOYSA-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 = 50120979   

TargetDihydrofolate reductase(Escherichia coli)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50120979(2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-...)
Affinity DataIC50: 900nMAssay Description:Inhibitory activity against Escherichia coli (ec) Dihydrofolate reductaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Toxoplasma gondii)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50120979(2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-...)
Affinity DataIC50: 900nMAssay Description:Inhibitory activity against Toxoplasma gondii (tg) Dihydrofolate reductase (DHFR)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Pneumocystis carinii)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50120979(2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-...)
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibitory activity against pneumocystis carinii Dihydrofolate reductaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Human)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50120979(2-[4-(2,4-Diamino-7,8-dihydro-5H-1,3,6,9-tetraaza-...)
Affinity DataIC50: 5.40E+3nMAssay Description:Inhibitory activity against recombinant human Dihydrofolate reductaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed