BDBM50142840 (R)-2-[(R)-(3,4-Dichloro-phenyl)-methoxycarbonyl-methyl]-piperidinium; chloride::(R)-methyl 2-(3,4-dichlorophenyl)-2-((R)-piperidin-2-yl)acetate hydrochloride::CHEMBL54134
SMILES: COC(=O)[C@@H]([C@H]1CCCC[NH2+]1)c1ccc(Cl)c(Cl)c1
InChI Key: InChIKey=JUKMAYKVHWKRKY-CHWSQXEVSA-O
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)) | BDBM50142840 ((R)-2-[(R)-(3,4-Dichloro-phenyl)-methoxycarbonyl-m...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
School of Chemistry and Biochemistry Curated by ChEMBL | Assay Description Displacement of [3H]WIN-35428 from DAT in Sprague-Dawley rat striatum | J Med Chem 50: 2718-31 (2007) Article DOI: 10.1021/jm061354p BindingDB Entry DOI: 10.7270/Q2Q81DXB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent serotonin transporter (Rattus norvegicus (rat)) | BDBM50142840 ((R)-2-[(R)-(3,4-Dichloro-phenyl)-methoxycarbonyl-m...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 667 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
School of Chemistry and Biochemistry Curated by ChEMBL | Assay Description Displacement of [3H]citalopram from 5HTT in Sprague-Dawley rat cerebrum | J Med Chem 50: 2718-31 (2007) Article DOI: 10.1021/jm061354p BindingDB Entry DOI: 10.7270/Q2Q81DXB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent dopamine transporter (Rattus norvegicus (rat)) | BDBM50142840 ((R)-2-[(R)-(3,4-Dichloro-phenyl)-methoxycarbonyl-m...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
School of Chemistry and Biochemistry Curated by ChEMBL | Assay Description Inhibition of [3H]DA uptake at DAT in Sprague-Dawley rat striatum | J Med Chem 50: 2718-31 (2007) Article DOI: 10.1021/jm061354p BindingDB Entry DOI: 10.7270/Q2Q81DXB | |||||||||||
More data for this Ligand-Target Pair |