BDBM50132250 9H-Xanthene-9-carboxylic acid [4-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-but-2-enyl]-amide::CHEMBL322466

SMILES: Cc1cn(C\C=C/CNC(=O)C2c3ccccc3Oc3ccccc23)c(=O)[nH]c1=O

InChI Key: InChIKey=NMYQZZMLNDDYIU-SREVYHEPSA-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 = 50132250   

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))	BDBM50132250 (9H-Xanthene-9-carboxylic acid [4-(5-methyl-2,4-dio...) Show SMILES Cc1cn(C\C=C/CNC(=O)C2c3ccccc3Oc3ccccc23)c(=O)[nH]c1=O Show InChI InChI=1S/C23H21N3O4/c1-15-14-26(23(29)25-21(15)27)13-7-6-12-24-22(28)20-16-8-2-4-10-18(16)30-19-11-5-3-9-17(19)20/h2-11,14,20H,12-13H2,1H3,(H,24,28)(H,25,27,29)/b7-6-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	3.30E+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
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50132250 (9H-Xanthene-9-carboxylic acid [4-(5-methyl-2,4-dio...) Show SMILES Cc1cn(C\C=C/CNC(=O)C2c3ccccc3Oc3ccccc23)c(=O)[nH]c1=O Show InChI InChI=1S/C23H21N3O4/c1-15-14-26(23(29)25-21(15)27)13-7-6-12-24-22(28)20-16-8-2-4-10-18(16)30-19-11-5-3-9-17(19)20/h2-11,14,20H,12-13H2,1H3,(H,24,28)(H,25,27,29)/b7-6-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.31E+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 HSV-1 Thymidine Kinase				Bioorg Med Chem Lett 13: 3027-30 (2003) BindingDB Entry DOI: 10.7270/Q2T15310
					More data for this Ligand-Target Pair