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Found 12 hits Enz. Inhib. hit(s) with Target = 'Thymidylate synthase' AND taxid = 226185   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thymidylate synthase


(Enterococcus faecalis)
BDBM50077844
PNG
(3,3-Bis-(4-hydroxy-phenyl)-3H-isobenzofuran-1-one ...)
Show SMILES Oc1ccc(cc1)C1(OC(=O)c2ccccc12)c1ccc(O)cc1
Show InChI InChI=1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22H
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PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350126
PNG
(CHEMBL1231545)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1cc(ccc1O)-c1ccccc1
Show InChI InChI=1S/C21H15NO3/c1-13-6-5-9-16-19(13)21(25)22(20(16)24)17-12-15(10-11-18(17)23)14-7-3-2-4-8-14/h2-12,23H,1H3
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2.00E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350123
PNG
(CHEMBL1229651)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1ccnc(Cl)c1
Show InChI InChI=1S/C14H9ClN2O2/c1-8-3-2-4-10-12(8)14(19)17(13(10)18)9-5-6-16-11(15)7-9/h2-7H,1H3
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7.00E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350124
PNG
(CHEMBL1231557)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1ccc(cc1)C#N
Show InChI InChI=1S/C16H10N2O2/c1-10-3-2-4-13-14(10)16(20)18(15(13)19)12-7-5-11(9-17)6-8-12/h2-8H,1H3
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8.00E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350142
PNG
(CHEMBL1814081)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1ccc(cc1)C(=O)NCC(O)=O
Show InChI InChI=1S/C18H14N2O5/c1-10-3-2-4-13-15(10)18(25)20(17(13)24)12-7-5-11(6-8-12)16(23)19-9-14(21)22/h2-8H,9H2,1H3,(H,19,23)(H,21,22)
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1.10E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350140
PNG
(CHEMBL1814080)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1nccs1
Show InChI InChI=1S/C12H8N2O2S/c1-7-3-2-4-8-9(7)11(16)14(10(8)15)12-13-5-6-17-12/h2-6H,1H3
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1.10E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350143
PNG
(CHEMBL1814084)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1cccc2[nH]ccc12
Show InChI InChI=1S/C17H12N2O2/c1-10-4-2-5-12-15(10)17(21)19(16(12)20)14-7-3-6-13-11(14)8-9-18-13/h2-9,18H,1H3
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2.60E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350125
PNG
(CHEMBL1814079)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1ccc(cc1)-n1ccnc1
Show InChI InChI=1S/C18H13N3O2/c1-12-3-2-4-15-16(12)18(23)21(17(15)22)14-7-5-13(6-8-14)20-10-9-19-11-20/h2-11H,1H3
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3.30E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350122
PNG
(CHEMBL1814078)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H10F3NO2/c1-9-3-2-4-12-13(9)15(22)20(14(12)21)11-7-5-10(6-8-11)16(17,18)19/h2-8H,1H3
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6.00E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350127
PNG
(CHEMBL1814082)
Show SMILES Cc1cccc2C(=O)N(C(=O)c12)c1cccc(O)c1
Show InChI InChI=1S/C15H11NO3/c1-9-4-2-7-12-13(9)15(19)16(14(12)18)10-5-3-6-11(17)8-10/h2-8,17H,1H3
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6.10E+4n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350134
PNG
(CHEMBL1814088)
Show SMILES CCOC(=O)c1ccc(NCc2cccc3C(=O)N(C)C(=O)c23)cc1
Show InChI InChI=1S/C19H18N2O4/c1-3-25-19(24)12-7-9-14(10-8-12)20-11-13-5-4-6-15-16(13)18(23)21(2)17(15)22/h4-10,20H,3,11H2,1-2H3
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1.09E+5n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair
Thymidylate synthase


(Enterococcus faecalis)
BDBM50350135
PNG
(CHEMBL1814089)
Show SMILES COCCCNCc1cccc2C(=O)N(C)C(=O)c12
Show InChI InChI=1S/C14H18N2O3/c1-16-13(17)11-6-3-5-10(12(11)14(16)18)9-15-7-4-8-19-2/h3,5-6,15H,4,7-9H2,1-2H3
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PubMed
1.83E+5n/an/an/an/an/an/an/an/a



Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assay


Citation and Details
More data for this
Ligand-Target Pair