BDBM50202384 (RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piperidine::(RS/SR)-2-[1-(4-chlorophenyl)-4-methylpentyl]piperidine::CHEMBL373710

SMILES: CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1

InChI Key: InChIKey=XANSRGJYZPYJFY-UHFFFAOYSA-N

Data: 6 KI  6 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 12 hits for monomerid = 50202384   

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
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	510	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	830	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human NET expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt 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
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Displacement of [125I]RTI-55 from human NET expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]DA uptake at human DAT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT uptake into human SERT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT uptake into human SERT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]NE uptake into human NET expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]DA uptake at human DAT expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50202384 ((RR/SS)-2-[1-(4-chlorophenyl)-4-methylpentyl]piper...) Show SMILES CC(C)CCC(C1CCCCN1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H26ClN/c1-13(2)6-11-16(17-5-3-4-12-19-17)14-7-9-15(18)10-8-14/h7-10,13,16-17,19H,3-6,11-12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts College of Pharmacy and Health Sciences Curated by ChEMBL					Assay Description Inhibition of [3H]NE uptake into human NET expressing HEK293 cells				J Med Chem 50: 219-32 (2007) Article DOI: 10.1021/jm0608614 BindingDB Entry DOI: 10.7270/Q2PN96F3
					More data for this Ligand-Target Pair