BDBM50054748 CHEMBL141882::N*1*-(2-Benzhydryloxy-ethyl)-2,2-dimethyl-propane-1,3-diamine

SMILES: CC(C)(CN)CNCCOC(c1ccccc1)c1ccccc1

InChI Key: InChIKey=AUSBQGUOSUIIQF-UHFFFAOYSA-N

Data: 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 3 hits for monomerid = 50054748   

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))	BDBM50054748 (CHEMBL141882 | N*1*-(2-Benzhydryloxy-ethyl)-2,2-di...) Show SMILES CC(C)(CN)CNCCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C20H28N2O/c1-20(2,15-21)16-22-13-14-23-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19,22H,13-16,21H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+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 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
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50054748 (CHEMBL141882 | N*1*-(2-Benzhydryloxy-ethyl)-2,2-di...) Show SMILES CC(C)(CN)CNCCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C20H28N2O/c1-20(2,15-21)16-22-13-14-23-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19,22H,13-16,21H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	453	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))	BDBM50054748 (CHEMBL141882 | N*1*-(2-Benzhydryloxy-ethyl)-2,2-di...) Show SMILES CC(C)(CN)CNCCOC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C20H28N2O/c1-20(2,15-21)16-22-13-14-23-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19,22H,13-16,21H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	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