BDBM50084341 (2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-amine::CHEMBL63703

SMILES: C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1

InChI Key: InChIKey=PSNHNKLTGOOICN-UHFFFAOYSA-N

Data: 3 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 6 hits for monomerid = 50084341   

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))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [125I]RTI-55 binding to dopamine transporter				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Binding affinity at the norepinephrine transporter was measured using [125I]RTI-55 as a radioligand				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	2.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Binding affinity for serotonin transporter using [125I]RTI-55				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]dopamine reuptake in HEK293 cells expressing human dopamine transporter				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]NE reuptake by human norepinephrine transporter expressed in HEK293 cells				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50084341 ((2-Benzhydryloxy-ethyl)-(1-benzyl-piperidin-4-yl)-...) Show SMILES C(COC(c1ccccc1)c1ccccc1)NC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C27H32N2O/c1-4-10-23(11-5-1)22-29-19-16-26(17-20-29)28-18-21-30-27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,26-28H,16-22H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts General Hospital Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT reuptake in HEK293 cells expressing human serotonin transporter				J Med Chem 43: 205-13 (2000) BindingDB Entry DOI: 10.7270/Q2JH3MW0
					More data for this Ligand-Target Pair