BDBM50272462 CHEMBL525528::N-(Adamant-1-yl)-7-fluoro-4-oxo-1-pentyl-1,4-dihydroquinoline-3-carboxamide
SMILES: CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2ccc(F)cc12
InChI Key: InChIKey=MPLSJVAMFMAOKU-UHFFFAOYSA-N
Data: 6 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cannabinoid receptor 2 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]CP-55940 from human CB2 receptor expressed in HEK293 cells | J Med Chem 51: 5075-84 (2008) Article DOI: 10.1021/jm800552f BindingDB Entry DOI: 10.7270/Q20R9Q9B | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 2 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]CP55940 from human recombinant CB2 receptor transfected in HEK cell membranes | Eur J Med Chem 58: 30-43 (2012) Article DOI: 10.1016/j.ejmech.2012.09.035 BindingDB Entry DOI: 10.7270/Q2JD4XW2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 2 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]-CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins by Competition binding assay | J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 30.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]CP55940 from human recombinant CB1 receptor transfected in HEK cell membrane | Eur J Med Chem 58: 30-43 (2012) Article DOI: 10.1016/j.ejmech.2012.09.035 BindingDB Entry DOI: 10.7270/Q2JD4XW2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 30.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]CP-55940 from human CB1 receptor expressed in HEK293 cells | J Med Chem 51: 5075-84 (2008) Article DOI: 10.1021/jm800552f BindingDB Entry DOI: 10.7270/Q20R9Q9B | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Homo sapiens (Human)) | BDBM50272462 (CHEMBL525528 | N-(Adamant-1-yl)-7-fluoro-4-oxo-1-p...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Displacement of [3H]-CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins by Competition binding assay | J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB | |||||||||||
More data for this Ligand-Target Pair |