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ChEMBL ligand: CHEMBL796 (Concerta, Cotempla xr-odt, Daytrana, Methylin, Methylphenidate, Methylphenidate extended release, Prc-063, Threo-dl-methylphenidate) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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DAT/Dopamine transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL238] [GtoPdb: 927] [UniProtKB: Q01959] | ||||||||
ChEMBL | Displacement of [125I]RTI-55 from human DAT expressing HEK293 cells | B | 6.96 | pKi | 110 | nM | Ki | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
ChEMBL | Displacement of [3H]WIN 35,428 from human DAT expressed in HEK293E cells after 1 hr by liquid scintillation counting | B | 7.47 | pKi | 34 | nM | Ki | ACS Med Chem Lett (2014) 5: 760-765 [PMID:25050161] |
GtoPdb | - | - | 7.1 | pIC50 | 79 | nM | IC50 | J Med Chem (2007) 50: 219-32 [PMID:17228864] |
ChEMBL | Inhibition of [3H]DA uptake at human DAT expressing HEK293 cells | B | 7.1 | pIC50 | 79 | nM | IC50 | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
ChEMBL | Inhibition of [3H]WIN-35428 Binding to the Dopamine Transporter in Rhesus (Macaca mulatta) orCynomolgus Monkey (Macaca fascicularis) Caudate-Putamen | B | 7.77 | pIC50 | 17 | nM | IC50 | J Med Chem (2003) 46: 1538-1545 [PMID:12672255] |
DAT/Dopamine transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL338] [GtoPdb: 927] [UniProtKB: P23977] | ||||||||
ChEMBL | Tested for the ability to bind stereoselectively and enantioselectively to the dopamine transporter (DAT); Value ranges from 34 - 83 nM | B | 7.08 | pIC50 | 83 | nM | IC50 | J Med Chem (2003) 46: 1538-1545 [PMID:12672255] |
NET/Norepinephrine transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL222] [GtoPdb: 926] [UniProtKB: P23975] | ||||||||
ChEMBL | Displacement of [125I]RTI-55 from human NET expressing HEK293 cells | B | 6.18 | pKi | 660 | nM | Ki | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
ChEMBL | Displacement of [3H]Nisoxetine from human NET expressed in HEK293E cells after 1 hr by liquid scintillation counting | B | 6.47 | pKi | 340 | nM | Ki | ACS Med Chem Lett (2014) 5: 760-765 [PMID:25050161] |
GtoPdb | - | - | 7.21 | pIC50 | 61 | nM | IC50 | |
ChEMBL | Inhibition of [3H]NE uptake into human NET expressing HEK293 cells | B | 7.21 | pIC50 | 61 | nM | IC50 | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
SERT/Serotonin transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL228] [GtoPdb: 928] [UniProtKB: P31645] | ||||||||
ChEMBL | Displacement of [125I]RTI-55 from human SERT expressing HEK293 cells | B | 4.19 | pKi | 65000 | nM | Ki | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
ChEMBL | Displacement of [3H]Citolapram from human SERT expressed in HEK293E cells after 1 hr by liquid scintillation counting | B | 5 | pKi | >10000 | nM | Ki | ACS Med Chem Lett (2014) 5: 760-765 [PMID:25050161] |
ChEMBL | Inhibition of [3H]5-HT uptake into human SERT expressing HEK293 cells | B | 5.29 | pIC50 | 5100 | nM | IC50 | J Med Chem (2007) 50: 219-232 [PMID:17228864] |
ChEMBL data shown on this page come from version 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]