null

SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(O)=O)cc1

InChI Key: InChIKey=ABZOSEUSDSPLFJ-NDEPHWFRSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 36703   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Thymidylate synthase (Lactobacillus casei)	BDBM36703 (Dansyl derivative, 7L | Dansyltyrosine deriviative...) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(O)=O)cc1 |r| Show InChI InChI=1S/C32H28N2O6S/c1-34(2)29-11-5-10-27-26(29)9-6-12-30(27)41(38,39)40-25-17-13-21(14-18-25)19-28(32(36)37)33-31(35)24-16-15-22-7-3-4-8-23(22)20-24/h3-18,20,28H,19H2,1-2H3,(H,33,35)(H,36,37)/t28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Modena e Reggio Emilia via Campi 183					Assay Description All compounds were screened for inhibitory activity against Lactobacillus casei thymidylate synthase (LcTS) and Escherichia coli thymidylate synthase...				Chembiochem 9: 779-90 (2008) Article DOI: 10.1002/cbic.200700524 BindingDB Entry DOI: 10.7270/Q2PG1Q89
					More data for this Ligand-Target Pair
Thymidylate synthase (Escherichia coli)	BDBM36703 (Dansyl derivative, 7L | Dansyltyrosine deriviative...) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(O)=O)cc1 |r| Show InChI InChI=1S/C32H28N2O6S/c1-34(2)29-11-5-10-27-26(29)9-6-12-30(27)41(38,39)40-25-17-13-21(14-18-25)19-28(32(36)37)33-31(35)24-16-15-22-7-3-4-8-23(22)20-24/h3-18,20,28H,19H2,1-2H3,(H,33,35)(H,36,37)/t28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.47E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Modena e Reggio Emilia via Campi 183					Assay Description All compounds were screened for inhibitory activity against Lactobacillus casei thymidylate synthase (LcTS) and Escherichia coli thymidylate synthase...				Chembiochem 9: 779-90 (2008) Article DOI: 10.1002/cbic.200700524 BindingDB Entry DOI: 10.7270/Q2PG1Q89
					More data for this Ligand-Target Pair
Thymidylate synthase (Lactobacillus casei)	BDBM36703 (Dansyl derivative, 7L | Dansyltyrosine deriviative...) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(O)=O)cc1 |r| Show InChI InChI=1S/C32H28N2O6S/c1-34(2)29-11-5-10-27-26(29)9-6-12-30(27)41(38,39)40-25-17-13-21(14-18-25)19-28(32(36)37)33-31(35)24-16-15-22-7-3-4-8-23(22)20-24/h3-18,20,28H,19H2,1-2H3,(H,33,35)(H,36,37)/t28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	7.4	20
Northwestern University					Assay Description The enzyme assay were performed spectrophotometrically by following the absorbance at 340nm using a hewlett Packard 8453 UV spectrophotometer equippe...				Chem Biol 6: 319-31 (1999) Article DOI: 10.1016/S1074-5521(99)80077-5 BindingDB Entry DOI: 10.7270/Q2S180VB
					More data for this Ligand-Target Pair