BDBM50265432 1-(2-Methylallyl)-4-phenylpiperidine-4-carbonitrile::CHEMBL495548

SMILES: CC(=C)CN1CCC(CC1)(C#N)c1ccccc1

InChI Key: InChIKey=LUZOXVOSNJFBRE-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 = 50265432   

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
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50265432 (1-(2-Methylallyl)-4-phenylpiperidine-4-carbonitril...) Show SMILES CC(=C)CN1CCC(CC1)(C#N)c1ccccc1 Show InChI InChI=1S/C16H20N2/c1-14(2)12-18-10-8-16(13-17,9-11-18)15-6-4-3-5-7-15/h3-7H,1,8-12H2,2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 opioid receptor in rat brain cerebellum				Eur J Med Chem 43: 1304-8 (2008) Article DOI: 10.1016/j.ejmech.2007.09.026 BindingDB Entry DOI: 10.7270/Q2W37W3G
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50265432 (1-(2-Methylallyl)-4-phenylpiperidine-4-carbonitril...) Show SMILES CC(=C)CN1CCC(CC1)(C#N)c1ccccc1 Show InChI InChI=1S/C16H20N2/c1-14(2)12-18-10-8-16(13-17,9-11-18)15-6-4-3-5-7-15/h3-7H,1,8-12H2,2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Binding affinity to delta opioid receptor				Eur J Med Chem 43: 1304-8 (2008) Article DOI: 10.1016/j.ejmech.2007.09.026 BindingDB Entry DOI: 10.7270/Q2W37W3G
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50265432 (1-(2-Methylallyl)-4-phenylpiperidine-4-carbonitril...) Show SMILES CC(=C)CN1CCC(CC1)(C#N)c1ccccc1 Show InChI InChI=1S/C16H20N2/c1-14(2)12-18-10-8-16(13-17,9-11-18)15-6-4-3-5-7-15/h3-7H,1,8-12H2,2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Binding affinity to mu opioid receptor				Eur J Med Chem 43: 1304-8 (2008) Article DOI: 10.1016/j.ejmech.2007.09.026 BindingDB Entry DOI: 10.7270/Q2W37W3G
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50265432 (1-(2-Methylallyl)-4-phenylpiperidine-4-carbonitril...) Show SMILES CC(=C)CN1CCC(CC1)(C#N)c1ccccc1 Show InChI InChI=1S/C16H20N2/c1-14(2)12-18-10-8-16(13-17,9-11-18)15-6-4-3-5-7-15/h3-7H,1,8-12H2,2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Binding affinity to kappa opioid receptor				Eur J Med Chem 43: 1304-8 (2008) Article DOI: 10.1016/j.ejmech.2007.09.026 BindingDB Entry DOI: 10.7270/Q2W37W3G
					More data for this Ligand-Target Pair