BDBM50265437 1-Phenylbutyl-4-phenylpiperidine-4-carbonitrile::CHEMBL495760

SMILES: N#CC1(CCN(CCCCc2ccccc2)CC1)c1ccccc1

InChI Key: InChIKey=IJFBHUIFPTXRGV-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 = 50265437   

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)	BDBM50265437 (1-Phenylbutyl-4-phenylpiperidine-4-carbonitrile | ...) Show SMILES N#CC1(CCN(CCCCc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C22H26N2/c23-19-22(21-12-5-2-6-13-21)14-17-24(18-15-22)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49	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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50265437 (1-Phenylbutyl-4-phenylpiperidine-4-carbonitrile | ...) Show SMILES N#CC1(CCN(CCCCc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C22H26N2/c23-19-22(21-12-5-2-6-13-21)14-17-24(18-15-22)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.80E+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 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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50265437 (1-Phenylbutyl-4-phenylpiperidine-4-carbonitrile | ...) Show SMILES N#CC1(CCN(CCCCc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C22H26N2/c23-19-22(21-12-5-2-6-13-21)14-17-24(18-15-22)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-18H2	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 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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50265437 (1-Phenylbutyl-4-phenylpiperidine-4-carbonitrile | ...) Show SMILES N#CC1(CCN(CCCCc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C22H26N2/c23-19-22(21-12-5-2-6-13-21)14-17-24(18-15-22)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-18H2	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