BDBM50013850 4-{8-[1-(4-Chloro-phenyl)-ethyl]-4-oxo-1,3,8-triaza-spiro[4.5]dec-1-yl}-benzenediazonium::CHEMBL84237

SMILES: CC(N1CCC2(CC1)N(CNC2=O)c1ccc(cc1)[N+]#N)c1ccc(Cl)cc1

InChI Key: InChIKey=UAVZMUHWDQZXRS-UHFFFAOYSA-O

Data: 3 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 3 hits for monomerid = 50013850   

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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50013850 (4-{8-[1-(4-Chloro-phenyl)-ethyl]-4-oxo-1,3,8-triaz...) Show SMILES CC(N1CCC2(CC1)N(CNC2=O)c1ccc(cc1)[N+]#N)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H22ClN5O/c1-15(16-2-4-17(22)5-3-16)26-12-10-21(11-13-26)20(28)24-14-27(21)19-8-6-18(25-23)7-9-19/h2-9,15H,10-14H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of [3H]DAGO binding to rat brain membrane Opioid receptor mu 1				J Med Chem 33: 2456-64 (1990) BindingDB Entry DOI: 10.7270/Q21Z451M
					More data for this Ligand-Target Pair
Opioid receptor (Rattus norvegicus (rat)-RAT)	BDBM50013850 (4-{8-[1-(4-Chloro-phenyl)-ethyl]-4-oxo-1,3,8-triaz...) Show SMILES CC(N1CCC2(CC1)N(CNC2=O)c1ccc(cc1)[N+]#N)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H22ClN5O/c1-15(16-2-4-17(22)5-3-16)26-12-10-21(11-13-26)20(28)24-14-27(21)19-8-6-18(25-23)7-9-19/h2-9,15H,10-14H2,1H3/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of [3H]diprenorphine binding to rat brain membrane opioid receptors;(T= total opioid receptor family)				J Med Chem 33: 2456-64 (1990) BindingDB Entry DOI: 10.7270/Q21Z451M
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50013850 (4-{8-[1-(4-Chloro-phenyl)-ethyl]-4-oxo-1,3,8-triaz...) Show SMILES CC(N1CCC2(CC1)N(CNC2=O)c1ccc(cc1)[N+]#N)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H22ClN5O/c1-15(16-2-4-17(22)5-3-16)26-12-10-21(11-13-26)20(28)24-14-27(21)19-8-6-18(25-23)7-9-19/h2-9,15H,10-14H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Opioid receptor delta 1 apparent binding constant from rat brain membranes using [3H]DADLE binding assay				J Med Chem 33: 2456-64 (1990) BindingDB Entry DOI: 10.7270/Q21Z451M
					More data for this Ligand-Target Pair