BDBM50167489 5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-trione::CHEMBL373311

SMILES: CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1

InChI Key: InChIKey=LAHYEFDNWASMJY-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 = 50167489   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50167489 (5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-t...) Show SMILES CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C18H16N2O4/c1-18(15(21)19-17(23)20-16(18)22)13-7-9-14(10-8-13)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro binding affinity against matrix metalloprotease 2				Bioorg Med Chem Lett 15: 2970-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.039 BindingDB Entry DOI: 10.7270/Q2028R2B
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50167489 (5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-t...) Show SMILES CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C18H16N2O4/c1-18(15(21)19-17(23)20-16(18)22)13-7-9-14(10-8-13)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro binding affinity against matrix metalloprotease 9				Bioorg Med Chem Lett 15: 2970-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.039 BindingDB Entry DOI: 10.7270/Q2028R2B
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50167489 (5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-t...) Show SMILES CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C18H16N2O4/c1-18(15(21)19-17(23)20-16(18)22)13-7-9-14(10-8-13)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,19,20,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro binding affinity against matrix metalloprotease 13				Bioorg Med Chem Lett 15: 2970-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.039 BindingDB Entry DOI: 10.7270/Q2028R2B
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50167489 (5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-t...) Show SMILES CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C18H16N2O4/c1-18(15(21)19-17(23)20-16(18)22)13-7-9-14(10-8-13)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro binding affinity against matrix metalloprotease 1				Bioorg Med Chem Lett 15: 2970-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.039 BindingDB Entry DOI: 10.7270/Q2028R2B
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50167489 (5-(4-Benzyloxy-phenyl)-5-methyl-pyrimidine-2,4,6-t...) Show SMILES CC1(C(=O)NC(=O)NC1=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C18H16N2O4/c1-18(15(21)19-17(23)20-16(18)22)13-7-9-14(10-8-13)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibitory concentration against human tumor necrosis factor-alpha converting enzyme				Bioorg Med Chem Lett 15: 2970-3 (2005) Article DOI: 10.1016/j.bmcl.2005.04.039 BindingDB Entry DOI: 10.7270/Q2028R2B
					More data for this Ligand-Target Pair