BDBM25745 3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluoromethoxy)phenyl]urea::US10383835, Compound 1709::US9296693, 55::Urea-based compound, 26
SMILES: CS(=O)(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
InChI Key: InChIKey=YORLNOBDSZJFQQ-UHFFFAOYSA-N
Data: 11 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Epoxide Hydrolase B (EHB) (Mycobacterium tuberculosis) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.79E+4 | n/a | n/a | n/a | n/a | 7.0 | 30 |
University of Alberta | Assay Description Enzyme activity was measured by monitoring the appearance of fluorescent product, 6-methoxy-naphthaldehyde (ex@330 nm and em@ 465 nm) on a SpectraMax... | J Mol Biol 381: 897-912 (2008) Article DOI: 10.1016/j.jmb.2008.06.030 BindingDB Entry DOI: 10.7270/Q2D50K94 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | 7.0 | n/a |
The Regents of the University of California US Patent | Assay Description IC50 values were determined using a sensitive fluorescent based assay (Anal. Biochem. 2005, 343, 66-75). Cyano(2-methoxynaphthalen-6-yl)methyl trans-... | US Patent US9296693 (2016) BindingDB Entry DOI: 10.7270/Q2TX3D7M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Soluble epoxide hydrolase (sEH) (Mus musculus (Mouse)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.0 | n/a |
The Regents of the University of California US Patent | Assay Description IC50 values were determined using a sensitive fluorescent based assay (Anal. Biochem. 2005, 343, 66-75). Cyano(2-methoxynaphthalen-6-yl)methyl trans-... | US Patent US9296693 (2016) BindingDB Entry DOI: 10.7270/Q2TX3D7M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Soluble epoxide hydrolase (sEH) (Mus musculus (Mouse)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Entomology and University of California Davis Cancer Center Curated by ChEMBL | Assay Description Inhibition of mouse recombinant soluble epoxide hydrolase by fluorescence assay | J Med Chem 53: 7067-75 (2010) Article DOI: 10.1021/jm100691c BindingDB Entry DOI: 10.7270/Q2GH9J6V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Entomology and University of California Davis Cancer Center Curated by ChEMBL | Assay Description Inhibition of human recombinant soluble epoxide hydrolase by fluorescence assay | J Med Chem 53: 7067-75 (2010) Article DOI: 10.1021/jm100691c BindingDB Entry DOI: 10.7270/Q2GH9J6V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Soluble Epoxide Hydrolase (Canis lupus familiaris (Dog) (Canis familiaris)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent | Assay Description The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ... | US Patent US10383835 (2019) BindingDB Entry DOI: 10.7270/Q2XD141M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Epoxide hydrolase (Equus caballus (Horse)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent | Assay Description The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ... | US Patent US10383835 (2019) BindingDB Entry DOI: 10.7270/Q2XD141M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Epoxide hydrolase (Ovis aries (Sheep)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent | Assay Description The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ... | US Patent US10383835 (2019) BindingDB Entry DOI: 10.7270/Q2XD141M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Soluble Epoxide Hydrolase (Sus scrofa (Pig)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent | Assay Description The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ... | US Patent US10383835 (2019) BindingDB Entry DOI: 10.7270/Q2XD141M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Epoxide hydrolase 1 (Felis catus (Cat) (Felis silvestris catus)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 565 | n/a | n/a | n/a | n/a | n/a | n/a |
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent | Assay Description The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ... | US Patent US10383835 (2019) BindingDB Entry DOI: 10.7270/Q2XD141M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human)) | BDBM25745 (3-(1-methanesulfonylpiperidin-4-yl)-1-[4-(trifluor...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California Curated by ChEMBL | Assay Description Inhibition of human recombinant soluble epoxide hydrolase assessed as cyano(6-methoxy-naphthalen-2-yl)methyl trans-[(3-phenyloxyran-2-yl)methyl] carb... | Bioorg Med Chem Lett 23: 3732-7 (2013) Article DOI: 10.1016/j.bmcl.2013.05.011 BindingDB Entry DOI: 10.7270/Q2057HBP | |||||||||||
More data for this Ligand-Target Pair |