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ChEMBL ligand: CHEMBL86304 (Aurorix, GNF-PF-695, Manerix, Moclobemide, RO 11-1163/000, RO-111163000) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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Kv11.1/HERG in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809] | ||||||||
ChEMBL | Inhibition of human ERG | B | 4.1 | pIC50 | 79432.82 | nM | IC50 | Eur J Med Chem (2011) 46: 618-630 [PMID:21185626] |
Monoamine oxidase A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1951] [GtoPdb: 2489] [UniProtKB: P21397] | ||||||||
ChEMBL | Inhibition of recombinant human MAO-A using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate addition measured for 15 mins by amplex red assay | B | 6.96 | pKi | 110 | nM | Ki | ACS Med Chem Lett (2016) 7: 56-61 [PMID:26819666] |
ChEMBL | Inhibition of recombinant human MAO-A assessed as reduction in H2O2 production preincubated for 30 mins followed by p-tyramine substrate addition measured after 30 mins by amplex red reagent based fluorescence assay | B | 6.99 | pKi | 102 | nM | Ki | Medchemcomm (2018) 9: 1164-1171 [PMID:30109004] |
ChEMBL | Inhibition of recombinant human MAO-A expressed in baculovirus infected BTI insect cells using p-tyramine as substrate incubated for 30 mins by Amplex red reagent based fluorescence analysis | B | 7 | pKi | 100 | nM | Ki | J Med Chem (2021) 64: 1989-2009 [PMID:33533632] |
ChEMBL | Inhibition of human MAOA expressed in baculovirus-infected BTI insect cells assessed as H2O2 production by resorufin dye based fluorimetric method | B | 7.85 | pKi | 14 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 3278-3284 [PMID:24986657] |
GtoPdb | - | - | 8.3 | pKi | 5 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 4296-300 [PMID:21680183] |
ChEMBL | Inhibition of human MAO-A expressed in BTI insect cells using p-tyramine as substrate after 60 mins | B | 8.3 | pKi | 5 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 4296-4300 [PMID:21680183] |
ChEMBL | Competitive reversible inhibition of human recombinant MAO-A expressed in baculovirus infected BT1 insect cells using p-tyramine as substrate assessed as H2O2 production after 15 mins by fluorimetric analysis | B | 8.3 | pKi | 5 | nM | Ki | Eur J Med Chem (2013) 69: 762-767 [PMID:24099995] |
ChEMBL | Inhibition of human MAO-A using tyramine hydrochloride as substrate after 30 mins by Amplex Red reagent based horseradish peroxidase enzyme-coupled fluorescence assay | B | 5.22 | pIC50 | 6061 | nM | IC50 | Eur J Med Chem (2018) 144: 68-81 [PMID:29248751] |
ChEMBL | Inhibition of human recombinant MAO-A using tyramine as substrate preincubated with enzyme for 30 mins followed by incubation with substrate for 30 mins by Amplex Red reagent based fluorometric method | B | 5.33 | pIC50 | 4664 | nM | IC50 | RSC Med Chem (2020) 11: 1063-1074 [PMID:33479699] |
ChEMBL | Inhibition of human recombinant MAO-A expressed in baculovirus infected BTI cells using p-tyramine as substrate after 15 mins by Amplex Red-based fluorescence assay | B | 5.44 | pIC50 | 3613.8 | nM | IC50 | Eur J Med Chem (2016) 108: 542-552 [PMID:26717204] |
ChEMBL | Inhibition of human recombinant MAOA expressed in BTI-TN-5B1-4 cells using p-tyramine substrate assessed as reduction in H2O2 production | B | 6.44 | pIC50 | 361.38 | nM | IC50 | Bioorg Med Chem Lett (2015) 25: 642-648 [PMID:25532905] |
Monoamine oxidase A in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3254] [UniProtKB: P21398] | ||||||||
ChEMBL | Inhibitory activity against monoamine oxidase A in isolated bovine brain mitochondria | B | 4.94 | pKi | 11500 | nM | Ki | J Med Chem (2003) 46: 917-920 [PMID:12620068] |
ChEMBL | Inhibition of bovine brain mitochondria MAOA by fluorometric assay | B | 4.94 | pKi | 11500 | nM | Ki | J Med Chem (2007) 50: 922-931 [PMID:17256833] |
ChEMBL | Inhibition of bovine brain mitochondrial MAO-A by fluorometric assay | B | 4.94 | pKi | 11500 | nM | Ki | Bioorg Med Chem (2008) 16: 9729-9740 [PMID:18951803] |
ChEMBL | Inhibition of bovine brain MAOA using kinuramine as substrate preincubated for 30 mins prior to substrate addition measured after 30 mins by fluorometric assay | B | 4.94 | pKi | 11500 | nM | Ki | J Med Chem (2012) 55: 10424-10436 [PMID:23153282] |
ChEMBL | Inhibition of MAO-A in bovine brain mitochondria using serotonin as substrate preincubated for 30 mins measured after 30 mins by spectrofluorimetric analysis | B | 4.88 | pIC50 | 13100 | nM | IC50 | Bioorg Med Chem Lett (2015) 25: 5281-5285 [PMID:26428872] |
ChEMBL | Inhibition of MAO-A in bovine brain mitochondria by fluorimetric method | B | 4.94 | pIC50 | 11481.54 | nM | IC50 | J Med Chem (2007) 50: 425-428 [PMID:17266193] |
ChEMBL | Inhibition of bovine mitochondrial MAOA | B | 4.94 | pIC50 | 11481.54 | nM | IC50 | Eur J Med Chem (2008) 43: 2262-2267 [PMID:18281126] |
ChEMBL | Inhibition of bovine brain MAO-A preincubated for 60 mins before substrate addition by fluorimetric method | B | 4.96 | pIC50 | 11000 | nM | IC50 | Eur J Med Chem (2015) 93: 308-320 [PMID:25707011] |
Monoamine oxidase A in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3358] [UniProtKB: P21396] | ||||||||
ChEMBL | Displacement of [3H]-Ro 41-1049 from MAO-A receptor in rat cerebral cortex | B | 4.93 | pKi | 11748.98 | nM | Ki | J Med Chem (2012) 55: 3242-3249 [PMID:22385498] |
ChEMBL | Displacement of [3H]Ro 41-1049 from MAO-A in rat cerebral cortex by competition binding assay | B | 4.94 | pKi | 11500 | nM | Ki | J Med Chem (2012) 55: 9735-9750 [PMID:23043306] |
ChEMBL | Inhibitory concentration for rat Monoamine oxidase A | B | 4.94 | pKi | 11500 | nM | Ki | J Med Chem (2005) 48: 4220-4223 [PMID:15974574] |
ChEMBL | Inhibition of MAO-A in rat liver homogenate after 60 mins by Lineweaver-Burke plot | B | 5.26 | pKi | 5530 | nM | Ki | Bioorg Med Chem (2009) 17: 675-689 [PMID:19091581] |
ChEMBL | Competitive inhibition of MAOA in rat liver homogenate by spectrophotometrically | B | 8.26 | pKi | 5.53 | nM | Ki | Bioorg Med Chem (2009) 17: 6761-6772 [PMID:19682910] |
ChEMBL | Competitive inhibition of MAOA in rat liver homogenate after 60 mins by Lineweaver-Burke plot analysis | B | 8.26 | pKi | 5.53 | nM | Kic | Bioorg Med Chem (2010) 18: 1875-1881 [PMID:20149663] |
ChEMBL | Inhibition of MAO-A in rat liver homogenate by spectrophotometry-based Holt method | B | 8.3 | pKi | 5 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 132-136 [PMID:19945874] |
ChEMBL | Inhibition of MAOA in Sprague-Dawley rat liver mitochondria using p-tyramine as substrate measured for 45 mins in presence of MAOB inhibitor selegiline by continuous fluorescence-based method | B | 4.97 | pIC50 | 10700 | nM | IC50 | Eur J Med Chem (2017) 127: 470-492 [PMID:28107736] |
ChEMBL | Inhibition of MAO-A in Sprague-Dawley rat brain mitochondrial suspension using kynuramine as substrate incubated for 5 mins prior to substrate addition measured for 5 mins by spectrophotometry | B | 5 | pIC50 | 10000 | nM | IC50 | J Med Chem (2013) 56: 2651-2664 [PMID:23437843] |
ChEMBL | Inhibition of MAOA in Sprague-Dawley rat brain mitochondria using kynuramine substrate by fluorimetry | B | 5.17 | pIC50 | 6800 | nM | IC50 | Bioorg Med Chem (2010) 18: 1659-1664 [PMID:20117937] |
ChEMBL | Inhibition of rat MAOA using 5-hydroxytryptamine as substrate pretreated for 1200 secs followed by substrate addition and measured after 3600 secs | B | 5.2 | pIC50 | 6300 | nM | IC50 | Bioorg Med Chem (2018) 26: 4863-4870 [PMID:30143367] |
ChEMBL | Competitive inhibition of MAOA in rat liver homogenate by spectrophotometrically | B | 5.24 | pIC50 | 5700 | nM | IC50 | Bioorg Med Chem (2009) 17: 6761-6772 [PMID:19682910] |
ChEMBL | Inhibition of MAO-A in rat liver homogenate after 60 mins by residual activity plot | B | 5.41 | pIC50 | 3900 | nM | IC50 | Bioorg Med Chem (2009) 17: 675-689 [PMID:19091581] |
ChEMBL | Inhibition of MAOA in rat liver homogenates preincubated for 60 mins | B | 5.41 | pIC50 | 3900 | nM | IC50 | Bioorg Med Chem Lett (2008) 18: 6362-6368 [PMID:18980841] |
Monoamine oxidase B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2039] [GtoPdb: 2490] [UniProtKB: P27338] | ||||||||
ChEMBL | Inhibitory concentration for human Monoamine oxidase B | B | 4 | pKi | 100000 | nM | Ki | J Med Chem (2005) 48: 4220-4223 [PMID:15974574] |
ChEMBL | Inhibition of recombinant human MAO-B expressed in baculovirus infected BTI insect cells using p-tyramine as substrate incubated for 30 mins by Amplex red reagent based fluorescence analysis | B | 5.12 | pKi | 7660 | nM | Ki | J Med Chem (2021) 64: 1989-2009 [PMID:33533632] |
ChEMBL | Inhibition of recombinant human MAO-B assessed as reduction in H2O2 production preincubated for 30 mins followed by p-tyramine substrate addition measured after 30 mins by amplex red reagent based fluorescence assay | B | 5.37 | pKi | 4220 | nM | Ki | Medchemcomm (2018) 9: 1164-1171 [PMID:30109004] |
ChEMBL | Inhibition of recombinant human MAO-B using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate addition measured for 15 mins by amplex red assay | B | 5.65 | pKi | 2240 | nM | Ki | ACS Med Chem Lett (2016) 7: 56-61 [PMID:26819666] |
ChEMBL | Inhibition of human MAOB expressed in baculovirus-infected BTI insect cells assessed as H2O2 production by resorufin dye based fluorimetric method | B | 5.87 | pKi | 1340 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 3278-3284 [PMID:24986657] |
ChEMBL | Competitive reversible inhibition of human recombinant MAO-B expressed in baculovirus infected BT1 insect cells using p-tyramine as substrate assessed as H2O2 production after 15 mins by fluorimetric analysis | B | 5.97 | pKi | 1080 | nM | Ki | Eur J Med Chem (2013) 69: 762-767 [PMID:24099995] |
ChEMBL | Inhibition of human MAO-B expressed in BTI insect cells using p-tyramine as substrate after 60 mins | B | 5.97 | pKi | 1080 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 4296-4300 [PMID:21680183] |
GtoPdb | - | - | 5.97 | pKi | 1080 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 4296-300 [PMID:21680183] |
ChEMBL | Inhibition of human MAO-B using p-tyramine as substrate by Amplex Red reagent based fluorescence analysis | B | 4 | pIC50 | >100000 | nM | IC50 | Eur J Med Chem (2020) 190: 112090-112090 [PMID:32018096] |
ChEMBL | Inhibition of human recombinant MAO-B using tyramine as substrate by fluorescence assay | B | 4 | pIC50 | >100000 | nM | IC50 | J Med Chem (2022) 65: 4727-4751 [PMID:35245051] |
Monoamine oxidase B in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2756] [UniProtKB: P56560] | ||||||||
ChEMBL | Inhibitory activity against monoamine oxidase B in isolated bovine brain mitochondria | B | 4 | pKi | >100000 | nM | Ki | J Med Chem (2003) 46: 917-920 [PMID:12620068] |
ChEMBL | Inhibition of bovine brain mitochondria MAOB by fluorometric assay | B | 4 | pKi | >100000 | nM | Ki | J Med Chem (2007) 50: 922-931 [PMID:17256833] |
ChEMBL | Inhibition of bovine brain mitochondrial MAO-B by fluorometric assay | B | 4 | pKi | >100000 | nM | Ki | Bioorg Med Chem (2008) 16: 9729-9740 [PMID:18951803] |
ChEMBL | Inhibition of bovine brain MAOB using kinuramine as substrate preincubated for 30 mins prior to substrate addition measured after 30 mins by fluorometric assay | B | 4 | pKi | >100000 | nM | Ki | J Med Chem (2012) 55: 10424-10436 [PMID:23153282] |
Monoamine oxidase B in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2993] [GtoPdb: 2490] [UniProtKB: P19643] | ||||||||
ChEMBL | Displacement of [3H]-Ro 16-6491 from MAO-B receptor in rat cerebral cortex | B | 4 | pKi | >100000 | nM | Ki | J Med Chem (2012) 55: 3242-3249 [PMID:22385498] |
ChEMBL | Inhibition of MAO-B in rat liver homogenate after 60 mins by Lineweaver-Burke plot | B | 4.99 | pKi | 10210 | nM | Ki | Bioorg Med Chem (2009) 17: 675-689 [PMID:19091581] |
ChEMBL | Competitive inhibition of MAOB in rat liver homogenate by spectrophotometrically | B | 5.97 | pKi | 1080 | nM | Ki | Bioorg Med Chem (2009) 17: 6761-6772 [PMID:19682910] |
ChEMBL | Inhibition of MAO-B in rat liver homogenate by spectrophotometry-based Holt method | B | 5.97 | pKi | 1080 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 132-136 [PMID:19945874] |
ChEMBL | Competitive inhibition of MAOB in rat liver homogenate after 60 mins by Lineweaver-Burke plot analysis | B | 5.97 | pKi | 1080 | nM | Kic | Bioorg Med Chem (2010) 18: 1875-1881 [PMID:20149663] |
ChEMBL | Inhibition of MAOB in Sprague-Dawley rat brain mitochondria using kynuramine substrate by fluorimetry | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem (2010) 18: 1659-1664 [PMID:20117937] |
ChEMBL | Competitive inhibition of MAOB in rat liver homogenate by spectrophotometrically | B | 4.05 | pIC50 | 89550 | nM | IC50 | Bioorg Med Chem (2009) 17: 6761-6772 [PMID:19682910] |
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364] | ||||||||
ChEMBL | NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay | F | 5.9 | pEC50 | >1250 | nM | EC50 | Proc Natl Acad Sci U S A (2008) 105: 9059-9064 [PMID:18579783] |
ChEMBL | NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay | F | 6.13 | pEC50 | >740 | nM | EC50 | Proc Natl Acad Sci U S A (2008) 105: 9059-9064 [PMID:18579783] |
5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908] | ||||||||
ChEMBL | Binding affinity to 5HT1A receptor | B | 5.3 | pKd | 5011.87 | nM | Kd | J Med Chem (2009) 52: 6107-6125 [PMID:19754201] |
σ2/Sigma intracellular receptor 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4105907] [GtoPdb: 2553] [UniProtKB: Q5BJF2] | ||||||||
ChEMBL | Displacement of [3H]-DTG from S2R in human Jurkat cell membranes after 1 hr in presence of (+)-pentazocine by liquid scintillation counting | B | 6.7 | pKi | >200 | nM | Ki | Eur J Med Chem (2017) 138: 964-978 [PMID:28756263] |
sigma non-opioid intracellular receptor 1/Sigma opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL287] [GtoPdb: 2552] [UniProtKB: Q99720] | ||||||||
ChEMBL | Displacement of [3H](+)-pentazocine from S1R in human Jurkat cell membranes after 2 hrs by liquid scintillation counting | B | 7 | pKi | >100 | nM | Ki | Eur J Med Chem (2017) 138: 964-978 [PMID:28756263] |
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]