BDBM50121758 CHEMBL274649::amino[(2,4-dioxo-1,2,3,4-tetrahydrothieno[3,2-d]pyrimidin-6-yl)amino]methaniminium acetate

SMILES: NC(N)=[NH+]c1cc2[nH]c(=O)[nH]c(=O)c2s1

InChI Key: InChIKey=PITNPYNKEVGJRQ-UHFFFAOYSA-O

Data: 1 KI

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 = 50121758   

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
Thymidine Phosphorylase (TP) (Homo sapiens (Human))	BDBM50121758 (CHEMBL274649 | amino[(2,4-dioxo-1,2,3,4-tetrahydro...) Show SMILES NC(N)=[NH+]c1cc2[nH]c(=O)[nH]c(=O)c2s1 |(3.87,-4.29,;3.09,-2.95,;1.54,-2.95,;3.84,-1.61,;5.39,-1.59,;6.3,-2.83,;7.76,-2.34,;9.08,-3.12,;10.43,-2.35,;11.76,-3.12,;10.43,-.8,;9.08,-.03,;9.07,1.51,;7.75,-.8,;6.29,-.34,)| Show InChI InChI=1S/C7H7N5O2S/c8-6(9)11-3-1-2-4(15-3)5(13)12-7(14)10-2/h1H,(H4,8,9,11)(H2,10,12,13,14)/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>2.40E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Attenuon, L.L.C. Curated by ChEMBL					Assay Description Binding affinity towards recombinant thymidine phosphorylase TP				Bioorg Med Chem Lett 13: 107-10 (2002) BindingDB Entry DOI: 10.7270/Q2GM87V9
					More data for this Ligand-Target Pair