BDBM50439106 CHEMBL2418074

SMILES: Clc1ccc(cc1Cl)-c1nc2[nH]c(=S)[nH]c(=O)n2n1

InChI Key: InChIKey=HEEUTQZCYUHGBE-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 50439106   

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))	BDBM50439106 (CHEMBL2418074) Show SMILES Clc1ccc(cc1Cl)-c1nc2[nH]c(=S)[nH]c(=O)n2n1 Show InChI InChI=1S/C10H5Cl2N5OS/c11-5-2-1-4(3-6(5)12)7-13-8-14-9(19)15-10(18)17(8)16-7/h1-3H,(H2,13,14,15,16,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.01E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National University of Singapore Curated by ChEMBL					Assay Description Mixed inhibition of human recombinant thymidine phosphorylase expressed in Escherichia coli using thymidine as substrate by Lineweaver-Burk plot anal...				Eur J Med Chem 67: 325-34 (2013) Article DOI: 10.1016/j.ejmech.2013.06.051 BindingDB Entry DOI: 10.7270/Q2QR4ZJ0
					More data for this Ligand-Target Pair
Thymidine Phosphorylase (TP) (Homo sapiens (Human))	BDBM50439106 (CHEMBL2418074) Show SMILES Clc1ccc(cc1Cl)-c1nc2[nH]c(=S)[nH]c(=O)n2n1 Show InChI InChI=1S/C10H5Cl2N5OS/c11-5-2-1-4(3-6(5)12)7-13-8-14-9(19)15-10(18)17(8)16-7/h1-3H,(H2,13,14,15,16,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
National University of Singapore Curated by ChEMBL					Assay Description Inhibition of human recombinant thymidine phosphorylase expressed in Escherichia coli using thymidine as substrate after 4 to 20 mins by spectrophoto...				Eur J Med Chem 67: 325-34 (2013) Article DOI: 10.1016/j.ejmech.2013.06.051 BindingDB Entry DOI: 10.7270/Q2QR4ZJ0
					More data for this Ligand-Target Pair