BDBM50324657 6-Bromo-4-oxo-1-prop-2-ynyl-1,4-dihydro-quinoline-3-carboxylic acid adamantan-1-ylamide::CHEMBL1215978

SMILES: Brc1ccc2n(CC#C)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1

InChI Key: InChIKey=PHNRPWAVVNJJKR-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50324657   

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))	BDBM50324657 (6-Bromo-4-oxo-1-prop-2-ynyl-1,4-dihydro-quinoline-...) Show SMILES Brc1ccc2n(CC#C)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:21:16:23:20.22.19,21:20:23:16.15.17,17:18:22:16.15.21,THB:17:16:22:18.23.19| Show InChI InChI=1S/C23H23BrN2O2/c1-2-5-26-13-19(21(27)18-9-17(24)3-4-20(18)26)22(28)25-23-10-14-6-15(11-23)8-16(7-14)12-23/h1,3-4,9,13-16H,5-8,10-12H2,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49.8	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 in cell free system				Eur J Med Chem 46: 547-55 (2011) Article DOI: 10.1016/j.ejmech.2010.11.034 BindingDB Entry DOI: 10.7270/Q2CF9QCJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50324657 (6-Bromo-4-oxo-1-prop-2-ynyl-1,4-dihydro-quinoline-...) Show SMILES Brc1ccc2n(CC#C)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:21:16:23:20.22.19,21:20:23:16.15.17,17:18:22:16.15.21,THB:17:16:22:18.23.19| Show InChI InChI=1S/C23H23BrN2O2/c1-2-5-26-13-19(21(27)18-9-17(24)3-4-20(18)26)22(28)25-23-10-14-6-15(11-23)8-16(7-14)12-23/h1,3-4,9,13-16H,5-8,10-12H2,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49.8	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 HEK cells				J Med Chem 53: 5915-28 (2010) Article DOI: 10.1021/jm100123x BindingDB Entry DOI: 10.7270/Q2PC33BG
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50324657 (6-Bromo-4-oxo-1-prop-2-ynyl-1,4-dihydro-quinoline-...) Show SMILES Brc1ccc2n(CC#C)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:21:16:23:20.22.19,21:20:23:16.15.17,17:18:22:16.15.21,THB:17:16:22:18.23.19| Show InChI InChI=1S/C23H23BrN2O2/c1-2-5-26-13-19(21(27)18-9-17(24)3-4-20(18)26)22(28)25-23-10-14-6-15(11-23)8-16(7-14)12-23/h1,3-4,9,13-16H,5-8,10-12H2,(H,25,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.21E+3	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 HEK cells				J Med Chem 53: 5915-28 (2010) Article DOI: 10.1021/jm100123x BindingDB Entry DOI: 10.7270/Q2PC33BG
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50324657 (6-Bromo-4-oxo-1-prop-2-ynyl-1,4-dihydro-quinoline-...) Show SMILES Brc1ccc2n(CC#C)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:21:16:23:20.22.19,21:20:23:16.15.17,17:18:22:16.15.21,THB:17:16:22:18.23.19| Show InChI InChI=1S/C23H23BrN2O2/c1-2-5-26-13-19(21(27)18-9-17(24)3-4-20(18)26)22(28)25-23-10-14-6-15(11-23)8-16(7-14)12-23/h1,3-4,9,13-16H,5-8,10-12H2,(H,25,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.21E+3	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 in cell free system				Eur J Med Chem 46: 547-55 (2011) Article DOI: 10.1016/j.ejmech.2010.11.034 BindingDB Entry DOI: 10.7270/Q2CF9QCJ
					More data for this Ligand-Target Pair