BDBM36691 Dansyltyrosine deriviative 8B

SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NS(=O)(=O)c2cc(cs2)S(=O)(=O)c2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=JAIQHSRGIVBXSV-MHZLTWQESA-N

Data: 1 IC50

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 1 hit for monomerid = 36691   

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 (TS) (Lactobacillus casei)	BDBM36691 (Dansyltyrosine deriviative 8B) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(C[C@H](NS(=O)(=O)c2cc(cs2)S(=O)(=O)c2ccccc2)C(O)=O)cc1 |r| Show InChI InChI=1S/C31H28N2O9S4/c1-33(2)28-12-6-11-26-25(28)10-7-13-29(26)46(40,41)42-22-16-14-21(15-17-22)18-27(31(34)35)32-45(38,39)30-19-24(20-43-30)44(36,37)23-8-4-3-5-9-23/h3-17,19-20,27,32H,18H2,1-2H3,(H,34,35)/t27-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+5	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