BDBM50399281 CHEMBL2180818::US9102622, 14.1
SMILES: Oc1ccc(CCCCCCCS(F)(=O)=O)cc1
InChI Key: InChIKey=DWVKNBPHGUTQCN-UHFFFAOYSA-N
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 |
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Fatty-acid amide hydrolase 1 (aa 30-579) (Rattus norvegicus (rat)) | BDBM50399281 (CHEMBL2180818 | US9102622, 14.1) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | US Patent | 23 | -10.8 | 98 | n/a | n/a | n/a | n/a | n/a | 37 |
University of Connecticut US Patent | Assay Description All compound solutions are made to a concentration of 10 mM in DMSO. To test the stability of the compounds in enzyme assay conditions, 25 nmoles of ... | US Patent US9102622 (2015) BindingDB Entry DOI: 10.7270/Q2QJ7G20 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Rattus norvegicus (rat)) | BDBM50399281 (CHEMBL2180818 | US9102622, 14.1) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 163 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northeastern University Curated by ChEMBL | Assay Description Displacement of [3H]CP-55,940 from CB1 receptor in rat brain homogenates | J Med Chem 55: 10074-89 (2012) Article DOI: 10.1021/jm301205j BindingDB Entry DOI: 10.7270/Q2J967HK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 2 (MOUSE) | BDBM50399281 (CHEMBL2180818 | US9102622, 14.1) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 698 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northeastern University Curated by ChEMBL | Assay Description Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in HEK293 cells | J Med Chem 55: 10074-89 (2012) Article DOI: 10.1021/jm301205j BindingDB Entry DOI: 10.7270/Q2J967HK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Monoglyceride lipase (Homo sapiens (Human)) | BDBM50399281 (CHEMBL2180818 | US9102622, 14.1) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 427 | n/a | n/a | n/a | n/a | n/a | n/a |
Northeastern University Curated by ChEMBL | Assay Description Inhibition of recombinant human hexahistidine-tagged MGL expressed in Escherichia coli using AHMMCE as substrate after 15 mins by medium throughput f... | J Med Chem 55: 10074-89 (2012) Article DOI: 10.1021/jm301205j BindingDB Entry DOI: 10.7270/Q2J967HK | |||||||||||
More data for this Ligand-Target Pair |