BDBM50132256 CHEMBL102986::N-[4-(5-Methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-but-2-enyl]-2,2-diphenyl-acetamide

SMILES: Cc1cn(C\C=C/CNC(=O)C(c2ccccc2)c2ccccc2)c(=O)[nH]c1=O

InChI Key: InChIKey=NDILRUMMGDBGQL-HJWRWDBZSA-N

Data: 2 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 = 50132256   

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 kinase, cytosolic (Homo sapiens (Human))	BDBM50132256 (CHEMBL102986 | N-[4-(5-Methyl-2,4-dioxo-3,4-dihydr...) Show SMILES Cc1cn(C\C=C/CNC(=O)C(c2ccccc2)c2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C23H23N3O3/c1-17-16-26(23(29)25-21(17)27)15-9-8-14-24-22(28)20(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-13,16,20H,14-15H2,1H3,(H,24,28)(H,25,27,29)/b9-8-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.15E+5	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Química Médica (CSIC) Curated by ChEMBL					Assay Description Inhibitory concentration of the compound on phosphorylation of [methyl-3H]-dTh by human Thymidine Kinase 1				Bioorg Med Chem Lett 13: 3027-30 (2003) BindingDB Entry DOI: 10.7270/Q2T15310
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50132256 (CHEMBL102986 | N-[4-(5-Methyl-2,4-dioxo-3,4-dihydr...) Show SMILES Cc1cn(C\C=C/CNC(=O)C(c2ccccc2)c2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C23H23N3O3/c1-17-16-26(23(29)25-21(17)27)15-9-8-14-24-22(28)20(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-13,16,20H,14-15H2,1H3,(H,24,28)(H,25,27,29)/b9-8-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Química Médica (CSIC) Curated by ChEMBL					Assay Description Inhibitory concentration of the compound on phosphorylation of [methyl-3H]-dTh by human Thymidine Kinase 2				Bioorg Med Chem Lett 13: 3027-30 (2003) BindingDB Entry DOI: 10.7270/Q2T15310
					More data for this Ligand-Target Pair