BDBM50298801 (+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)but-1-ynyl)-6-methylpyrimidine-2,4-diamine::Biphenyl antifolate, 2::CHEMBL575217::US8853228, 140

SMILES COc1cc(cc(c1)-c1cc(C)cc(C)c1)C(C)C#Cc1c(C)nc(N)nc1N

InChI Key InChIKey=ATFDKOLABYIYCC-UHFFFAOYSA-N

Data  8 IC50

PDB links: 3 PDB IDs match this monomer.

  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 8 hits for monomerid = 50298801   

TargetDihydrofolate reductase(Candida Glabrata)
University Of Connecticut

LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  0.550nMAssay Description:Enzyme activity assay were performed by monitoring the rate of enzyme-dependent NADPH consumption at an absorbance of 340 nm over 5 min.More data for this Ligand-Target Pair
TargetDihydrofolate reductase(Homo sapiens (Human))
University Of Connecticut

LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  750nMAssay Description:Enzyme activity assay were performed by monitoring the rate of enzyme-dependent NADPH consumption at an absorbance of 340 nm over 5 min.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Staphylococcus aureus)
University Of Connecticut

US Patent
LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  42nMAssay Description:Heterocyclic analogs of propargyl-linked inhibitors of the third generation analogs were evaluated in enzyme inhibition assays, assessed for S. aur...More data for this Ligand-Target Pair
TargetDihydrofolate reductase(Homo sapiens (Human))
University Of Connecticut

LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  750nMAssay Description:Inhibition of human DHFR assessed as rate of NADPH consumption using dihydrofolate as susbtrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
University Of Connecticut

LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  750nMAssay Description:Heterocyclic analogs of propargyl-linked inhibitors of the third generation analogs were evaluated in enzyme inhibition assays, assessed for S. aur...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetDihydrofolate reductase(Staphylococcus aureus)
University Of Connecticut

US Patent
LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  42nMAssay Description:Inhibition of Staphylococcus aureus DHFRMore data for this Ligand-Target Pair
TargetDihydrofolate reductase(Candida albicans)
University Of Connecticut

Curated by ChEMBL
LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  17nMAssay Description:Inhibition of Candida albicans DHFR expressed in Escherichia coli BL21 (DE3) assessed as rate of NADPH consumption using dihydrofolate as susbtrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Streptococcus pyogenes)
University Of Connecticut

US Patent
LigandPNGBDBM50298801((+/-)-5-(3-(5-methoxy-3',5'-dimethylbiphenyl-3-yl)...)
Affinity DataIC50:  190nMAssay Description:Heterocyclic analogs of propargyl-linked inhibitors of the third generation analogs were evaluated in enzyme inhibition assays, assessed for S. aur...More data for this Ligand-Target Pair
In DepthDetails US Patent