BDBM50054736 CHEMBL140104::N-(2-Benzhydryloxy-ethyl)-N'-(3-phenyl-propyl)-butane-1,4-diamine

SMILES: C(CCNCCOC(c1ccccc1)c1ccccc1)CNCCCc1ccccc1

InChI Key: InChIKey=DKFCKRNSTGLFQA-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50054736   

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 (Rattus norvegicus (rat))	BDBM50054736 (CHEMBL140104 | N-(2-Benzhydryloxy-ethyl)-N'-(3-phe...) Show SMILES C(CCNCCOC(c1ccccc1)c1ccccc1)CNCCCc1ccccc1 Show InChI InChI=1S/C28H36N2O/c1-4-13-25(14-5-1)15-12-22-29-20-10-11-21-30-23-24-31-28(26-16-6-2-7-17-26)27-18-8-3-9-19-27/h1-9,13-14,16-19,28-30H,10-12,15,20-24H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Binding against Dopamine transporter using radioligand as [3H]GBR 12935				J Med Chem 39: 4704-16 (1997) Article DOI: 10.1021/jm960305h BindingDB Entry DOI: 10.7270/Q2QZ2BN6
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50054736 (CHEMBL140104 | N-(2-Benzhydryloxy-ethyl)-N'-(3-phe...) Show SMILES C(CCNCCOC(c1ccccc1)c1ccccc1)CNCCCc1ccccc1 Show InChI InChI=1S/C28H36N2O/c1-4-13-25(14-5-1)15-12-22-29-20-10-11-21-30-23-24-31-28(26-16-6-2-7-17-26)27-18-8-3-9-19-27/h1-9,13-14,16-19,28-30H,10-12,15,20-24H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Binding affinity against sigma receptor using radioligand ([3H](+)-pentazocine) binding assay				J Med Chem 39: 4704-16 (1997) Article DOI: 10.1021/jm960305h BindingDB Entry DOI: 10.7270/Q2QZ2BN6
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50054736 (CHEMBL140104 | N-(2-Benzhydryloxy-ethyl)-N'-(3-phe...) Show SMILES C(CCNCCOC(c1ccccc1)c1ccccc1)CNCCCc1ccccc1 Show InChI InChI=1S/C28H36N2O/c1-4-13-25(14-5-1)15-12-22-29-20-10-11-21-30-23-24-31-28(26-16-6-2-7-17-26)27-18-8-3-9-19-27/h1-9,13-14,16-19,28-30H,10-12,15,20-24H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of dopamine DA reuptake				J Med Chem 39: 4704-16 (1997) Article DOI: 10.1021/jm960305h BindingDB Entry DOI: 10.7270/Q2QZ2BN6
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50054736 (CHEMBL140104 | N-(2-Benzhydryloxy-ethyl)-N'-(3-phe...) Show SMILES C(CCNCCOC(c1ccccc1)c1ccccc1)CNCCCc1ccccc1 Show InChI InChI=1S/C28H36N2O/c1-4-13-25(14-5-1)15-12-22-29-20-10-11-21-30-23-24-31-28(26-16-6-2-7-17-26)27-18-8-3-9-19-27/h1-9,13-14,16-19,28-30H,10-12,15,20-24H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	376	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT reuptake at rat serotonin transporter				J Med Chem 39: 4704-16 (1997) Article DOI: 10.1021/jm960305h BindingDB Entry DOI: 10.7270/Q2QZ2BN6
					More data for this Ligand-Target Pair