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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 | 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 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 | Inhibition of human MAO-A by spectrofluorimetric analysis | B | 9.3 | pKi | 0.5 | nM | Ki | Eur J Med Chem (2020) 205: 112666-112666 [PMID:32795767] |
ChEMBL | Inhibition of MAO-A (unknown origin) | B | 4.96 | pIC50 | 11000 | nM | IC50 | Eur J Med Chem (2022) 229: 114085-114085 [PMID:34998058] |
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 MAO-A (unknown origin) | B | 5.22 | pIC50 | 6061 | nM | IC50 | Eur J Med Chem (2022) 229: 114097-114097 [PMID:34998057] |
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 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
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]