BDBM50018078 2-(4-Phenyl-piperidin-1-yl)-cyclohexanol::2-(4-Phenyl-piperidin-1-yl)-cyclohexanol([3H]-(-)Vesamicol)::CHEMBL20943::US10421722, Compound Vesamicolb::V-100

SMILES: OC1CCCCC1N1CCC(CC1)c1ccccc1

InChI Key: InChIKey=YSSBJODGIYRAMI-UHFFFAOYSA-N

Data: 7 KI  3 IC50

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 10 hits for monomerid = 50018078   

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
Vesicular acetylcholine transporter (Homo sapiens (Human))	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	9.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University US Patent					Assay Description The binding affinity of a compound to VAChT was measured by competition against the binding of 5 nM [3H]Vesamicol to postnuclear supernatant prepared...				US Patent US10421722 (2019) BindingDB Entry DOI: 10.7270/Q2BC41W3
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	22.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kanazawa University Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in Sprague-Dawley rat cerebral membrane after 90 mins by liquid scintillation counting				Bioorg Med Chem 20: 4936-41 (2012) Article DOI: 10.1016/j.bmc.2012.06.040 BindingDB Entry DOI: 10.7270/Q24B32DN
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
IQOG, CSIC Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from sigma1 receptor in rat brain membranes after 60 mins by liquid scintillation counting method				J Med Chem 61: 6937-6943 (2018) Article DOI: 10.1021/acs.jmedchem.8b00848 BindingDB Entry DOI: 10.7270/Q2QN699Q
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Rattus norvegicus)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	32.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kanazawa University Curated by ChEMBL					Assay Description Displacement of [125I]O-iodo-trans-decalinvesamicol from VAChT in Sprague-Dawley rat cerebral membrane after 1 hr by gamma counting				Bioorg Med Chem 20: 4936-41 (2012) Article DOI: 10.1016/j.bmc.2012.06.040 BindingDB Entry DOI: 10.7270/Q24B32DN
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Rattus norvegicus)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	33.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kanazawa University Curated by ChEMBL					Assay Description Displacement of (-)-[3H]vesamicol from VAChT in Sprague-Dawley rat cerebral membrane after 60 mins by liquid scintillation counting in presence of DT...				Bioorg Med Chem 20: 4936-41 (2012) Article DOI: 10.1016/j.bmc.2012.06.040 BindingDB Entry DOI: 10.7270/Q24B32DN
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Rattus norvegicus)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
IQOG, CSIC Curated by ChEMBL					Assay Description Displacement of (-)-[3H]vesamicol from rat VAChT expressed in rat PC12 cell membranes after 60 mins by liquid scintillation counting method				J Med Chem 61: 6937-6943 (2018) Article DOI: 10.1021/acs.jmedchem.8b00848 BindingDB Entry DOI: 10.7270/Q2QN699Q
					More data for this Ligand-Target Pair
Sigma-2 receptor (Rattus norvegicus (Rat))	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
IQOG, CSIC Curated by ChEMBL					Assay Description Displacement of [3H]DTG from sigma2 receptor in rat liver membranes after 60 mins by liquid scintillation counting method				J Med Chem 61: 6937-6943 (2018) Article DOI: 10.1021/acs.jmedchem.8b00848 BindingDB Entry DOI: 10.7270/Q2QN699Q
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Homo sapiens (Human))	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of active transport of [3H]-Acetylcholine using purified Torpedo californica synaptic vesicles				J Med Chem 32: 1217-30 (1989) BindingDB Entry DOI: 10.7270/Q2TQ60JR
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Homo sapiens (Human))	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of active transport of [3H]acetylcholine using purified Torpedo californica synaptic vesicles				J Med Chem 32: 1217-30 (1989) BindingDB Entry DOI: 10.7270/Q2TQ60JR
					More data for this Ligand-Target Pair
Vesicular acetylcholine transporter (Torpedo californica)	BDBM50018078 (2-(4-Phenyl-piperidin-1-yl)-cyclohexanol | 2-(4-Ph...) Show SMILES OC1CCCCC1N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C17H25NO/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14/h1-3,6-7,15-17,19H,4-5,8-13H2	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Displacement of [3H]-Vesamicol from Vesamicol receptor of Torpedo californica				J Med Chem 34: 2638-43 (1991) BindingDB Entry DOI: 10.7270/Q2XK8DHK
					More data for this Ligand-Target Pair