BDBM50090320 CHEMBL416073::N-[3-(4-Cyano-4-phenyl-piperidin-1-yl)-propyl]-2-cyclopentyl-2-phenyl-acetamide

SMILES: O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(C1CCCC1)c1ccccc1

InChI Key: InChIKey=CYPCIJWPPPMXEY-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 = 50090320   

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))	BDBM50090320 (CHEMBL416073 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(C1CCCC1)c1ccccc1 Show InChI InChI=1S/C28H35N3O/c29-22-28(25-14-5-2-6-15-25)16-20-31(21-17-28)19-9-18-30-27(32)26(24-12-7-8-13-24)23-10-3-1-4-11-23/h1-6,10-11,14-15,24,26H,7-9,12-13,16-21H2,(H,30,32)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	50	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))	BDBM50090320 (CHEMBL416073 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(C1CCCC1)c1ccccc1 Show InChI InChI=1S/C28H35N3O/c29-22-28(25-14-5-2-6-15-25)16-20-31(21-17-28)19-9-18-30-27(32)26(24-12-7-8-13-24)23-10-3-1-4-11-23/h1-6,10-11,14-15,24,26H,7-9,12-13,16-21H2,(H,30,32)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+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-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))	BDBM50090320 (CHEMBL416073 | N-[3-(4-Cyano-4-phenyl-piperidin-1-...) Show SMILES O=C(NCCCN1CCC(CC1)(C#N)c1ccccc1)C(C1CCCC1)c1ccccc1 Show InChI InChI=1S/C28H35N3O/c29-22-28(25-14-5-2-6-15-25)16-20-31(21-17-28)19-9-18-30-27(32)26(24-12-7-8-13-24)23-10-3-1-4-11-23/h1-6,10-11,14-15,24,26H,7-9,12-13,16-21H2,(H,30,32)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.30E+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