Compile Data Set for Download or QSAR
Found 11 Enz. Inhib. hit(s) with Target = 'Thymidylate synthase' and Ligand = 'BDBM18763'
TargetThymidylate synthase(Escherichia coli)
Università di Modena e Reggio Emilia

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  600nM ΔG°:  -34.9kJ/molepH: 7.0 T: 2°CAssay Description:The inhibition assay pattern for all of the compounds was determined by steady-state kinetic analysis of the dependence of the TS enzyme activity on ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TT4PDHPubMed
TargetThymidylate synthase(Escherichia coli)
Università di Modena e Reggio Emilia

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  600nM ΔG°:  -34.9kJ/molepH: 7.4 T: 2°CAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetThymidylate synthase(Escherichia coli)
Università di Modena e Reggio Emilia

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  700nMAssay Description:In vitro inhibition of Lactobacillus casei Thymidylate synthase.More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q23F4NT5PubMed
TargetThymidylate synthase(Escherichia coli)
Università di Modena e Reggio Emilia

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  700nM ΔG°:  -34.5kJ/molepH: 7.0 T: 2°CAssay Description:The inhibition assay pattern for all of the compounds was determined by steady-state kinetic analysis of the dependence of the TS enzyme activity on ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TT4PDHPubMed
TargetThymidylate synthase(Lactobacillus casei)
Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL
LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  700nMAssay Description:Inhibition of Lactobacillus casei thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assayMore data for this Ligand-Target Pair
TargetThymidylate synthase(Lactobacillus casei)
Universita degli Studi di Modena e Reggio Emilia

Curated by ChEMBL
LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  700nM ΔG°:  -34.5kJ/molepH: 7.4 T: 2°CAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
TargetThymidylate synthase(Pneumocystis carinii)
Università di Modena e Reggio Emilia

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  1.30E+4nM ΔG°:  -27.4kJ/molepH: 7.0 T: 2°CAssay Description:The inhibition assay pattern for all of the compounds was determined by steady-state kinetic analysis of the dependence of the TS enzyme activity on ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TT4PDHPubMed
TargetThymidylate synthase(Homo sapiens (Human))
UNIMORE

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  3.00E+4nMAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetThymidylate synthase(Homo sapiens (Human))
UNIMORE

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  3.00E+4nM ΔG°:  -25.4kJ/molepH: 7.0 T: 2°CAssay Description:The inhibition assay pattern for all of the compounds was determined by steady-state kinetic analysis of the dependence of the TS enzyme activity on ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TT4PDHPubMed
TargetThymidylate synthase(Homo sapiens (Human))
UNIMORE

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  3.00E+4nMAssay Description:Inhibition of human thymidylate synthase using N5,N10-methylene tetrahydrofolate by chromogenic assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2VH5P6DPubMed
TargetThymidylate synthase(Cryptococcus neoformans)
UNIMORE

LigandPNGBDBM18763(1,8-naphthalein derivative, 10 | 4,4-bis(3-chloro-...)copy SMILEScopy InChI
Affinity DataKi:  3.50E+4nMAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed