BDBM50259228 (1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1-phenylpropan-2-ol::(R,S/S,R)-syn-1-(methyl(o-tolyl)amino)-3-(methylamino)-1-phenylpropan-2-ol::CHEMBL469150

SMILES: CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1

InChI Key: InChIKey=VIHUCKRDYCSWQL-MSOLQXFVSA-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 = 50259228   

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 noradrenaline transporter (Homo sapiens (Human))	BDBM50259228 ((1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1...) Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1 |r| Show InChI InChI=1S/C18H24N2O/c1-14-9-7-8-12-16(14)20(3)18(17(21)13-19-2)15-10-5-4-6-11-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	217	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells				J Med Chem 53: 2051-62 (2010) Article DOI: 10.1021/jm901559e BindingDB Entry DOI: 10.7270/Q21J99VS
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50259228 ((1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1...) Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1 |r| Show InChI InChI=1S/C18H24N2O/c1-14-9-7-8-12-16(14)20(3)18(17(21)13-19-2)15-10-5-4-6-11-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of serotonin uptake at human SERT expressed in human JAR cells				Bioorg Med Chem Lett 19: 2464-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.054 BindingDB Entry DOI: 10.7270/Q2T43V1C
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50259228 ((1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1...) Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1 |r| Show InChI InChI=1S/C18H24N2O/c1-14-9-7-8-12-16(14)20(3)18(17(21)13-19-2)15-10-5-4-6-11-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	217	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of norepinephrine uptake at human NET expressed in MDCK-Net6 cells				Bioorg Med Chem Lett 19: 2464-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.054 BindingDB Entry DOI: 10.7270/Q2T43V1C
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50259228 ((1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1...) Show SMILES CNC[C@@H](O)[C@@H](N(C)c1ccccc1C)c1ccccc1 |r| Show InChI InChI=1S/C18H24N2O/c1-14-9-7-8-12-16(14)20(3)18(17(21)13-19-2)15-10-5-4-6-11-15/h4-12,17-19,21H,13H2,1-3H3/t17-,18+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of serotonin uptake at human SERT expressed in human JAR cells				J Med Chem 53: 2051-62 (2010) Article DOI: 10.1021/jm901559e BindingDB Entry DOI: 10.7270/Q21J99VS
					More data for this Ligand-Target Pair