BDBM50028333 6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione::CHEMBL54362

SMILES: CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1

InChI Key: InChIKey=XIKQUZTWHPFJKG-UHFFFAOYSA-N

Data: 4 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 5 hits for monomerid = 50028333   

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
DNA topoisomerase III (Bacillus subtilis)	BDBM50028333 (6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione | ...) Show SMILES CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1 Show InChI InChI=1S/C14H17N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12-9-13(18)17-14(19)16-12/h5-9H,2-4H2,1H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2.19E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition constant against Bacillus subtilis azp-12 DNA topoisomerase III (mutant enzyme).				J Med Chem 27: 181-5 (1984) BindingDB Entry DOI: 10.7270/Q2Q241FK
					More data for this Ligand-Target Pair
DNA polymerase IIIC (Bacillus subtilis)	BDBM50028333 (6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione | ...) Show SMILES CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1 Show InChI InChI=1S/C14H17N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12-9-13(18)17-14(19)16-12/h5-9H,2-4H2,1H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2.19E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibition of Bacillus subtilis DNA Polymerase III/azp-12(mutant).				J Med Chem 23: 34-8 (1980) BindingDB Entry DOI: 10.7270/Q2125RPK
					More data for this Ligand-Target Pair
DNA topoisomerase III (Bacillus subtilis)	BDBM50028333 (6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione | ...) Show SMILES CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1 Show InChI InChI=1S/C14H17N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12-9-13(18)17-14(19)16-12/h5-9H,2-4H2,1H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	4.95E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition constant against Bacillus subtilis DNA topoisomerase III (wild type).				J Med Chem 27: 181-5 (1984) BindingDB Entry DOI: 10.7270/Q2Q241FK
					More data for this Ligand-Target Pair
DNA topoisomerase III (Bacillus subtilis)	BDBM50028333 (6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione | ...) Show SMILES CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1 Show InChI InChI=1S/C14H17N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12-9-13(18)17-14(19)16-12/h5-9H,2-4H2,1H3,(H3,15,16,17,18,19)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	4.96E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition against Bacillus subtilis DNA topoisomerase III (wild type)				J Med Chem 23: 34-8 (1980) BindingDB Entry DOI: 10.7270/Q2125RPK
					More data for this Ligand-Target Pair
Uracil-DNA glycosylase (UNG) (Homo sapiens (Human))	BDBM50028333 (6-(4-Butyl-phenylamino)-1H-pyrimidine-2,4-dione | ...) Show SMILES CCCCc1ccc(Nc2cc(=O)[nH]c(=O)[nH]2)cc1 Show InChI InChI=1S/C14H17N3O2/c1-2-3-4-10-5-7-11(8-6-10)15-12-9-13(18)17-14(19)16-12/h5-9H,2-4H2,1H3,(H3,15,16,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical Center Curated by ChEMBL					Assay Description Inhibitory potency of the compound against HSV-1 UDG (Herpes Simplex virus type-I Uracil DNA glycosylase)				J Med Chem 42: 2344-50 (1999) Article DOI: 10.1021/jm980718d BindingDB Entry DOI: 10.7270/Q21J98ZQ
					More data for this Ligand-Target Pair