harmaline [Ligand Id: 13140] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL340807 (Harmaline) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Acetylcholinesterase in Electrophorus electricus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4078] [UniProtKB: O42275] | ||||||||
| ChEMBL | Inhibition of electric eel AChE using acetylcholine iodide as substrate measured every 5 sec for 2 mins by Ellman's method | B | 5.31 | pIC50 | 4900 | nM | IC50 | Bioorg Med Chem Lett (2012) 22: 2885-2888 [PMID:22425563] |
| acetylcholinesterase (Yt blood group)/Acetylcholinesterase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303] | ||||||||
| ChEMBL | Inhibition of human AChE by Ellman's method | B | 4.63 | pIC50 | 23700 | nM | IC50 | Bioorg Med Chem Lett (2012) 22: 2885-2888 [PMID:22425563] |
| dual specificity tyrosine phosphorylation regulated kinase 1A/Dual-specificity tyrosine-phosphorylation regulated kinase 1A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2292] [GtoPdb: 2009] [UniProtKB: Q13627] | ||||||||
| ChEMBL | Inhibition of DYRK1A (unknown origin) | B | 5.34 | pIC50 | 4600 | nM | IC50 | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| Monoamine oxidase A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1951] [GtoPdb: 2489] [UniProtKB: P21397] | ||||||||
| GtoPdb | - | - | 7.48 | pIC50 | 32.9 | nM | IC50 | Eur J Med Chem (2021) 209: 112911 [PMID:33071056] |
| ChEMBL | Inhibition of recombinant human MAO-A expressed in baculovirus infected BTI-TN-5B1-4 insect cells using p-tyramine as substrate preincubated for 15 mins followed by substrate addition and measured over 20 mins by horse-radish peroxidase/Amplex Red coupled fluorimetric analysis | B | 7.48 | pIC50 | 32.9 | nM | IC50 | Eur J Med Chem (2021) 209: 112911-112911 [PMID:33071056] |
| ChEMBL | Inhibition of MAO-A (unknown origin) | B | 8.6 | pIC50 | 2.5 | nM | IC50 | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| Monoamine oxidase A in Mouse [GtoPdb: 2489] [UniProtKB: Q64133] | ||||||||
| GtoPdb | Inhibition of MAOA activity in mouse brain | - | 7.92 | pIC50 | 12 | nM | IC50 | J Med Chem (1995) 38: 4786-92 [PMID:7490728] |
| Monoamine oxidase A in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3358] [UniProtKB: P21396] | ||||||||
| ChEMBL | In vitro inhibitory activity against rat brain Monoamine oxidase A | B | 7.92 | pIC50 | 12 | nM | IC50 | J Med Chem (1995) 38: 4786-4792 [PMID:7490728] |
| Monoamine oxidase B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2039] [GtoPdb: 2490] [UniProtKB: P27338] | ||||||||
| ChEMBL | Inhibition of recombinant human MAO-B expressed in baculovirus infected BTI-TN-5B1-4 insect cells using p-tyramine as substrate preincubated for 15 mins followed by substrate addition and measured over 20 mins by horse-radish peroxidase/Amplex Red coupled fluorimetric analysis | B | 4 | pIC50 | >100000 | nM | IC50 | Eur J Med Chem (2021) 209: 112911-112911 [PMID:33071056] |
| 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908] | ||||||||
| ChEMBL | Displacement of [3H]-ketanserin from human 5-HT1A expressed in human HEK cells assessed as inhibition constant by FLIPR assay | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT1B receptor/Serotonin 1b (5-HT1b) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1898] [GtoPdb: 2] [UniProtKB: P28222] | ||||||||
| ChEMBL | Displacement of [3H]-mesulergine from human 5-HT1B expressed in human HEK cells assessed as inhibition constant by FLIPR assay | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT1D receptor/Serotonin 1d (5-HT1d) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1983] [GtoPdb: 3] [UniProtKB: P28221] | ||||||||
| ChEMBL | Binding affinity to 5-HT1DR (unknown origin) assessed as inhibition constant | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223] | ||||||||
| ChEMBL | Displacement of [3H]-LSD from human 5-HT2A expressed in human HEK cells assessed as inhibition constant by FLIPR assay | B | 5.3 | pKi | 5000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL225] [GtoPdb: 8] [UniProtKB: P28335] | ||||||||
| ChEMBL | Displacement of [3H]-LSD from human 5-HT2C expressed in human HEK cells assessed as inhibition constant by FLIPR assay | B | 5.03 | pKi | 9400 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT3A/Serotonin 3a (5-HT3a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1899] [GtoPdb: 373] [UniProtKB: P46098] | ||||||||
| ChEMBL | Binding affinity to 5-HT3R (unknown origin) assessed as inhibition constant | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT5A receptor/Serotonin 5a (5-HT5a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3426] [GtoPdb: 10] [UniProtKB: P47898] | ||||||||
| ChEMBL | Binding affinity towards 5-hydroxytryptamine 5A receptor using lysergic acid diethylamide (LSD) as radioligand | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2003) 46: 3930-3937 [PMID:12930153] |
| ChEMBL | Binding affinity to 5-HT5AR (unknown origin) assessed as inhibition constant | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT6 receptor/Serotonin 6 (5-HT6) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3371] [GtoPdb: 11] [UniProtKB: P50406] | ||||||||
| ChEMBL | Binding affinity to 5-HT6R (unknown origin) assessed as inhibition constant | B | 5.82 | pKi | 1500 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
| 5-HT7 receptor/Serotonin 7 (5-HT7) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3155] [GtoPdb: 12] [UniProtKB: P34969] | ||||||||
| ChEMBL | Displacement of [3H]-citalopram from human 5-HT7 expressed in human HEK cells assessed as inhibition constant by FLIPR assay | B | 5.26 | pKi | 5500 | nM | Ki | J Med Chem (2021) 64: 1392-1422 [PMID:33528252] |
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]
