BDBM50170996 CHEMBL501902

SMILES: O=C1NC(=O)C2=CC=NC2=N1

InChI Key: InChIKey=CCUNTMAWJCQEDU-UHFFFAOYSA-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 = 50170996   

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) (Escherichia coli)	BDBM50170996 (CHEMBL501902) Show SMILES O=C1NC(=O)C2=CC=NC2=N1 |c:7,10,t:5| Show InChI InChI=1S/C6H3N3O2/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Quaid-i-Azam University Curated by ChEMBL					Assay Description Inhibition of recombinant Escherichia coli thymidine phosphorylase using thymidine as substrate measured after 10 mins at 30 degC by spectrophotometr...				Bioorg Med Chem 24: 2361-81 (2016) BindingDB Entry DOI: 10.7270/Q2TB18SH
					More data for this Ligand-Target Pair