venlafaxine [Ligand Id: 7321] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL637 (Alventa xl, Amphero xl, Bonilux xl, Depefex xl, Efectin, Efexor, Efexor xl, Effexor, Foraven xl, Kanghong, Mentaven xl, NSC-758676, Politid xl, Ranfaxine xl, Rodomel xl, Sunveniz xl, Tardcaps xl, Tifaxin xl, Tonpular xl, Trevilor, Trixat xl, Vaxalin xl, Velafax, Venaxx xl, Venlablue xl, Venladex xl, Venlafaxine, Venlalic xl, Venlaneo xl, Venlor, Vensir xl, Vexarin xl, Viepax, Viepax xl, Winfex xl)
  • α1A-adrenoceptor/Alpha-1a adrenergic receptor in Rat [ChEMBL: CHEMBL319] [GtoPdb: 22] [UniProtKB: P43140]
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  • NET/Norepinephrine transporter in Human [ChEMBL: CHEMBL222] [GtoPdb: 926] [UniProtKB: P23975]
  • Norepinephrine transporter in Rat [ChEMBL: CHEMBL304] [UniProtKB: Q9WTR4]
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  • 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Rat [ChEMBL: CHEMBL273] [GtoPdb: 1] [UniProtKB: P19327]
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  • 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Rat [ChEMBL: CHEMBL322] [GtoPdb: 6] [UniProtKB: P14842]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
α1A-adrenoceptor/Alpha-1a adrenergic receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL319] [GtoPdb: 22] [UniProtKB: P43140]
ChEMBL Inhibition of binding of [3H]imipramine to imipramine receptor in rat brain B 6.85 pIC50 140 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of binding of [3H]imipramine to imipramine receptor in rat brain B 6.96 pIC50 109 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of binding of [3H]imipramine to imipramine receptor in rat brain B 7.05 pIC50 90 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
DAT/Dopamine transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL238] [GtoPdb: 927] [UniProtKB: Q01959]
ChEMBL Equilibrium dissociation constant (KD) for Competitive binding between [3H]WIN-35428 and the compound at human transporter-hDAT B 5.03 pKd 9300 nM Kd Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL Binding affinity to human DAT expressed in HEK293 cells after 60 mins in presence of [3H]imipramine by liquid scintillation counting B 5.28 pKi 5300 nM Ki J Med Chem (2018) 61: 2133-2165 [PMID:28731336]
ChEMBL Inhibition of [3H]dopamine uptake at human DAT expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 5.44 pKi 3620 nM Ki Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Displacement of [3H]WIN35428 from human DAT transfected in HEK293 cells after 3 hrs by Wallac counting analysis B 6.05 pKi >890 nM Ki ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL Inhibition of DA reuptake at human DAT expressed in HEK293 cells after 15 mins by fluorescence neurotransmitter transporter assay B 4.8 pIC50 15767 nM IC50 Bioorg Med Chem Lett (2014) 24: 3234-3237 [PMID:24974340]
ChEMBL Displacement of [3H]WIN-35428 form human DAT expressed in CHO cell membranes B 5 pIC50 >10000 nM IC50 Bioorg Med Chem Lett (2010) 20: 2809-2812 [PMID:20378347]
ChEMBL Inhibition of [3H]dopamine uptake at human DAT expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 5.04 pIC50 9120.11 nM IC50 Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Inhibition of dopamine reuptake at human dopamine transporter expressed in CHO cells B 5.13 pIC50 7340 nM IC50 Bioorg Med Chem Lett (2010) 20: 5567-5571 [PMID:20724153]
ChEMBL Inhibition of DAT B 5.35 pIC50 4430 nM IC50 J Med Chem (2011) 54: 2529-2591 [PMID:21413808]
ChEMBL Inhibition of human DAT expressed in CHOK1 cells assessed as decrease in [3H]-dopamine reuptake after 10 mins by scintillation counting method B 5.35 pIC50 4430 nM IC50 J Med Chem (2018) 61: 3779-3798 [PMID:29039662]
DAT/Dopamine transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL338] [GtoPdb: 927] [UniProtKB: P23977]
ChEMBL Inhibition of [3H]- DA reuptake into rat striatal synaptosomes B 6.44 pKi 360 nM Ki Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL Binding affinity against dopamine transporter (DAT) by displacement of [3H]WIN-35428 in male wistar rats B 6 pIC50 >1000 nM IC50 J Med Chem (2003) 46: 5512-5532 [PMID:14640559]
NET/Norepinephrine transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL222] [GtoPdb: 926] [UniProtKB: P23975]
ChEMBL Equilibrium dissociation constant (KD) for Competitive binding between [3H]- nisoxatine and the compound at human Norepinephrine transporter B 5.97 pKd 1060 nM Kd Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL DRUGMATRIX: Norepinephrine Transporter radioligand binding (ligand: [125I] RTI-55) B 5.57 pKi 2685 nM Ki DrugMatrix in vitro pharmacology data
ChEMBL Inhibition of [3H]norepinephrine uptake at human NET expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 5.79 pKi 1623 nM Ki Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Displacement of [3H]Nisoxetine from human NET transfected in HEK293 cells after 3 hrs by Wallac counting analysis B 6.26 pKi >553 nM Ki ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL Displacement of [3H]nisoxetine from human norepinephrine transporter expressed in MDCK-Net6 cells B 6.41 pKi 385 nM Ki J Med Chem (2008) 51: 4038-4049 [PMID:18557608]
ChEMBL Binding affinity to human NET expressed in HEK293 cells after 60 mins in presence of [3H]imipramine by liquid scintillation counting B 6.68 pKi 210 nM Ki J Med Chem (2018) 61: 2133-2165 [PMID:28731336]
ChEMBL Inhibition of [3H]norepinephrine uptake at human NET expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 5.1 pIC50 7943.28 nM IC50 Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Inhibition of norepinephrine reuptake at human NET expressed in HEK293 cells after 15 mins by fluorescence neurotransmitter transporter assay B 5.24 pIC50 5722 nM IC50 Bioorg Med Chem Lett (2014) 24: 3234-3237 [PMID:24974340]
ChEMBL DRUGMATRIX: Norepinephrine Transporter radioligand binding (ligand: [125I] RTI-55) B 5.57 pIC50 2708 nM IC50 DrugMatrix in vitro pharmacology data
ChEMBL Displacement of [3H]Nisoxetine from human NET transfected in HEK293 cells after 3 hrs by Wallac counting analysis B 6.17 pIC50 680 nM IC50 ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL Inhibition of norepinephrine reuptake at human NET expressed in MDCK cells B 6.24 pIC50 581 nM IC50 Bioorg Med Chem Lett (2010) 20: 5567-5571 [PMID:20724153]
GtoPdb - - 6.27 pIC50 535 nM IC50 Bioorg Med Chem Lett (2010) 20: 2809-12 [PMID:20378347]
ChEMBL Inhibition of human NET transfected in MDCK-Net6 cells B 6.27 pIC50 535 nM IC50 Bioorg Med Chem Lett (2010) 20: 2809-2812 [PMID:20378347]
ChEMBL Inhibition of norepinephrine uptake at human norepinephrine transporter expressed in MDCK-Net6 cells B 6.27 pIC50 535 nM IC50 J Med Chem (2008) 51: 4038-4049 [PMID:18557608]
ChEMBL Inhibition of human NET expressed in MDCK cells assessed as decrease in [3H]-noradrenaline reuptake after 10 mins by scintillation counting method B 6.83 pIC50 149 nM IC50 J Med Chem (2018) 61: 3779-3798 [PMID:29039662]
ChEMBL Inhibition of NET B 6.83 pIC50 149 nM IC50 J Med Chem (2011) 54: 2529-2591 [PMID:21413808]
Norepinephrine transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL304] [UniProtKB: Q9WTR4]
ChEMBL Binding affinity against norepinephrine transporter (NET) by displacement of [3H]nisoxetine in male wistar rats B 6.14 pKi 719 nM Ki J Med Chem (2003) 46: 5512-5532 [PMID:14640559]
ChEMBL Inhibition of [3H]- NE reuptake into rat hippocampal synaptosomes B 6.86 pKi 138 nM Ki Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL Inhibition of uptake of tritiated norepinephrine (NE) into rat brain synaptosomes F 5.5 pIC50 3140 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of uptake of tritiated norepinephrine (NE) into rat brain synaptosomes F 6.12 pIC50 760 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of uptake of tritiated norepinephrine (NE) into rat brain synaptosomes F 6.19 pIC50 640 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL273] [GtoPdb: 1] [UniProtKB: P19327]
ChEMBL Binding affinity against 5-hydroxytryptamine 1A receptor (5-HT1A) by displacement of [3H]8-OH-DPAT from rat hippocampus membranes B 6 pIC50 >1000 nM IC50 J Med Chem (2003) 46: 5512-5532 [PMID:14640559]
5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL322] [GtoPdb: 6] [UniProtKB: P14842]
ChEMBL Binding affinity against 5-hydroxytryptamine 2A receptor by displacement of [3H]-ketanserin from rat prefrontal cerebral cortex mambranes B 6 pIC50 >1000 nM IC50 J Med Chem (2003) 46: 5512-5532 [PMID:14640559]
SERT/Serotonin transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL228] [GtoPdb: 928] [UniProtKB: P31645]
ChEMBL Equilibrium dissociation constant (KD) for Competitive binding between [3H]- imipramine and the compound at human transporter-hSERT B 8.05 pKd 8.9 nM Kd Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL Inhibition of [3H]5-HT uptake at human SERT expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 6.95 pKi 113 nM Ki Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Binding affinity to human SERT expressed in HEK293 cells after 60 mins in presence of [3H]imipramine by liquid scintillation counting B 7.41 pKi 39 nM Ki J Med Chem (2018) 61: 2133-2165 [PMID:28731336]
ChEMBL Displacement of [3H]citalopram from human SERT transfected in HEK293 cells after 3 hrs by Wallac counting analysis B 7.96 pKi 11 nM Ki ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL DRUGMATRIX: Transporter, Serotonin (5-Hydroxytryptamine) (SERT) radioligand binding (ligand: [3H] Paroxetine) B 8.42 pKi 3.81 nM Ki DrugMatrix in vitro pharmacology data
ChEMBL Inhibition of [3H]5-HT uptake at human SERT expressed in HEK293 cells preincubated for 10 mins prior to substrate addition measured after 4 mins by FLIPR assay B 6.49 pIC50 323.59 nM IC50 Bioorg Med Chem Lett (2013) 23: 3411-3415 [PMID:23602445]
ChEMBL Inhibition of serotonin reuptake at human SERT expressed in HEK293 cells after 15 mins by fluorescence neurotransmitter transporter assay B 7.44 pIC50 36.1 nM IC50 Bioorg Med Chem Lett (2014) 24: 3234-3237 [PMID:24974340]
ChEMBL Inhibition of serotonin reuptake at human SERT expressed in HEK293 cells B 7.46 pIC50 35 nM IC50 Bioorg Med Chem Lett (2010) 20: 5567-5571 [PMID:20724153]
ChEMBL Inhibition of 5HT uptake at human SERT expressed in human JAR cells B 7.51 pIC50 31 nM IC50 J Med Chem (2008) 51: 4038-4049 [PMID:18557608]
ChEMBL Inhibition of human SERT expressed in human JAR cells B 7.57 pIC50 27 nM IC50 Bioorg Med Chem Lett (2010) 20: 2809-2812 [PMID:20378347]
GtoPdb - - 7.57 pIC50 27 nM IC50 Bioorg Med Chem Lett (2010) 20: 2809-12 [PMID:20378347]
ChEMBL Inhibition of human SERT expressed in HEK293 cells assessed as decrease in [3H]-serotonin reuptake after 10 mins by scintillation counting method B 7.7 pIC50 20 nM IC50 J Med Chem (2018) 61: 3779-3798 [PMID:29039662]
ChEMBL Inhibition of SERT B 7.7 pIC50 20 nM IC50 J Med Chem (2011) 54: 2529-2591 [PMID:21413808]
ChEMBL Displacement of [3H]citalopram from human SERT transfected in HEK293 cells after 3 hrs by Wallac counting analysis B 7.7 pIC50 >20 nM IC50 ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL DRUGMATRIX: Transporter, Serotonin (5-Hydroxytryptamine) (SERT) radioligand binding (ligand: [3H] Paroxetine) B 8.14 pIC50 7.18 nM IC50 DrugMatrix in vitro pharmacology data
SERT/Serotonin transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL313] [GtoPdb: 928] [UniProtKB: P31652]
ChEMBL Binding affinity to the serotonin transporter (SERT) measured by displacement of [3H]paroxetine in male wistar rats B 7.28 pKi 52 nM Ki J Med Chem (2003) 46: 5512-5532 [PMID:14640559]
ChEMBL Inhibition of [3H]5-HT reuptake into rat frontal cortex synaptosomes B 7.43 pKi 37 nM Ki Bioorg Med Chem Lett (1998) 8: 487-492 [PMID:9871604]
ChEMBL Displacement of [3H]-citalopram from Sprague-Dawley rat brain SERT after 1 hr B 7.6 pKi 25 nM Ki ACS Med Chem Lett (2013) 4: 560-564 [PMID:24900709]
ChEMBL Inhibition of [3H]5HT reuptake at rat brain frontal cortex serotonin transporter B 6.46 pIC50 350 nM IC50 Bioorg Med Chem Lett (2010) 20: 1256-1259 [PMID:20022503]
ChEMBL Inhibition of uptake of tritiated serotonin (5-HT) into rat brain synaptosomes F 6.68 pIC50 210 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of 5HT uptake at rat brain SERT B 6.68 pIC50 210 nM IC50 J Med Chem (2008) 51: 4038-4049 [PMID:18557608]
ChEMBL Inhibition of uptake of tritiated serotonin (5-HT) into rat brain synaptosomes F 6.72 pIC50 190 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
ChEMBL Inhibition of uptake of tritiated serotonin (5-HT) into rat brain synaptosomes F 7 pIC50 100 nM IC50 J Med Chem (1990) 33: 2899-2905 [PMID:1976813]
Transporter in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6184] [UniProtKB: Q63380]
ChEMBL Inhibition of [3H]norepinephrine reuptake at rat brain frontal cortex norepinephrine transporter B 5.85 pIC50 1400 nM IC50 Bioorg Med Chem Lett (2010) 20: 1256-1259 [PMID:20022503]
ChEMBL Inhibition of norepinephrine uptake at rat brain norepinephrine transporter B 6.19 pIC50 640 nM IC50 J Med Chem (2008) 51: 4038-4049 [PMID:18557608]

ChEMBL data shown on this page come from version 32:

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]