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BDBM50340677 (5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione::5 fluorouracil::5-FU::5-Florouracil::5-Fluoro-1H-pyrimidine-2,4-dione::5-Fluoro-1H-pyrimidine-2,4-dione (5-FU)::5-Fluoro-1H-pyrimidine-2,4-dione (5-Fluorouracil)::5-Fluoro-1H-pyrimidine-2,4-dione(5-FU)::5-Fluoro-1H-pyrimidine-2,4-dione(5-FUra)::5-Fluoro-1H-pyrimidine-2,4-dione(5-fluoro uracil)::5-Fluoro-1H-pyrimidine-2,4-dione(5-fluorouracil)(5-FU)::5-Fluoro-1H-pyrimidine-2,4-dione(5FU)::5-Fluorouracil::5-fluoro-uracil::5-fluoropyrimidine-2,4(1H,3H)-dione::5-fluorouacil::5-fluorourasil::5F-uracil::Adrucil::CHEMBL185::Carac::Efudex::FLUOROURACIL, 5-::Fluoroplex::Fluracil::Ro-2-9757

SMILES: Fc1c[nH]c(=O)[nH]c1=O

InChI Key: InChIKey=GHASVSINZRGABV-UHFFFAOYSA-N

Data: 6 IC50

PDB links: 15 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50340677   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Epidermal growth factor receptor (EGFR)


(Homo sapiens (Human))
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
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Article
PubMed
n/an/a 320n/an/an/an/an/an/a



Nanjing University



Assay Description
Compounds 1-32 were dissolved in 100% DMSO and diluted to the appropriate concentrations with 25 mM HEPES at pH 7.4. In each well, 10 μL of comp...


J Enzyme Inhib Med Chem 26: 37-45 (2011)

More data for this
Ligand-Target Pair
Thymidylate synthase


(Mus musculus)
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
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PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of thymidylate synthase in mouse L1210 cells assessed as inhibition of tritium release from [5-3H]deoxyuridine after preincubation for 15 ...


Eur J Med Chem 46: 993-1005 (2011)

More data for this
Ligand-Target Pair
Thymidylate synthase


(Mus musculus)
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
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PubMed
n/an/a 60n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of thymidylate synthase in mouse L1210 cells assessed as inhibition of tritium release from [5-3H]deoxycytidine after preincubation for 24...


Eur J Med Chem 46: 993-1005 (2011)

More data for this
Ligand-Target Pair
Thymidylate synthase


(Mus musculus)
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
PDB
MMDB

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KEGG

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CHEMBL
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KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of thymidylate synthase in mouse L1210 cells assessed as inhibition of tritium release from [5-3H]deoxyuridine after preincubation for 24 ...


Eur J Med Chem 46: 993-1005 (2011)

More data for this
Ligand-Target Pair
Thymidylate synthase


(Mus musculus)
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
PDB
MMDB

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KEGG

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CHEMBL
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KEGG
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PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
n/an/a 600n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of thymidylate synthase in mouse L1210 cells assessed as inhibition of tritium release from [5-3H]deoxycytidine after preincubation for 4 ...


Eur J Med Chem 46: 993-1005 (2011)

More data for this
Ligand-Target Pair
Thymidylate synthase


(Mus musculus)
BDBM50340677
PNG
((5-fluorouracil)5-Fluoro-1H-pyrimidine-2,4-dione |...)
Show SMILES Fc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
n/an/a 220n/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of thymidylate synthase in mouse L1210 cells assessed as inhibition of tritium release from [5-3H]deoxyuridine after preincubation for 4 h...


Eur J Med Chem 46: 993-1005 (2011)

More data for this
Ligand-Target Pair