BDBM50090312 CHEMBL296965::N-[3-(4-Cyano-4-phenyl-piperidin-1-yl)-propyl]-2,2-diphenyl-acetamide

SMILES: O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=ZQCNGXUHVDDWMJ-UHFFFAOYSA-N

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 = 50090312   

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
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50090312 (CHEMBL296965 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H31N3O/c30-23-29(26-15-8-3-9-16-26)17-21-32(22-18-29)20-10-19-31-28(33)27(24-11-4-1-5-12-24)25-13-6-2-7-14-25/h1-9,11-16,27H,10,17-22H2,(H,31,33)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-HEAT to cloned human alpha-1A adrenergic receptor.				Bioorg Med Chem Lett 10: 1621-4 (2000) BindingDB Entry DOI: 10.7270/Q27W6BDJ
					More data for this Ligand-Target Pair
Adrenergic alpha1B (Homo sapiens (Human))	BDBM50090312 (CHEMBL296965 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H31N3O/c30-23-29(26-15-8-3-9-16-26)17-21-32(22-18-29)20-10-19-31-28(33)27(24-11-4-1-5-12-24)25-13-6-2-7-14-25/h1-9,11-16,27H,10,17-22H2,(H,31,33)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	840	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-HEAT to cloned human alpha-1B adrenergic receptor.				Bioorg Med Chem Lett 10: 1621-4 (2000) BindingDB Entry DOI: 10.7270/Q27W6BDJ
					More data for this Ligand-Target Pair
Alpha-1D adrenergic receptor (Homo sapiens (Human))	BDBM50090312 (CHEMBL296965 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H31N3O/c30-23-29(26-15-8-3-9-16-26)17-21-32(22-18-29)20-10-19-31-28(33)27(24-11-4-1-5-12-24)25-13-6-2-7-14-25/h1-9,11-16,27H,10,17-22H2,(H,31,33)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-HEAT to cloned human alpha-1D adrenergic receptor.				Bioorg Med Chem Lett 10: 1621-4 (2000) BindingDB Entry DOI: 10.7270/Q27W6BDJ
					More data for this Ligand-Target Pair