allicin [Ligand Id: 2419] activity data from GtoPdb and ChEMBL
Click here for a description of the charts and data table
Please tell us if you are using this feature and what you think!
| ChEMBL ligand: CHEMBL359965 (Allicin, Diallyl Thiosulfinate) |
|---|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| cathepsin B/Cathepsin B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4072] [GtoPdb: 2343] [UniProtKB: P07858] | ||||||||
| ChEMBL | Inhibition of cathepsin B | B | 5.07 | pKi | 8600 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 5541-5543 [PMID:20692829] |
| cathepsin L/Cathepsin L in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3837] [GtoPdb: 2351] [UniProtKB: P07711] | ||||||||
| ChEMBL | Inhibition of cathepsin L | B | 5.03 | pKi | 9300 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 5541-5543 [PMID:20692829] |
| Mitochondrial oxodicarboxylate carrier/Mitochondrial 2-oxodicarboxylate carrier in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4680040] [GtoPdb: 1057] [UniProtKB: Q9BQT8] | ||||||||
| ChEMBL | Inhibition of ODC (unknown origin) expressed in Escherichia coli after 30 mins in presence of [1-14C] L-ornithine by liquid scintillation counter analysis | B | 7.96 | pIC50 | 11 | nM | IC50 | J Nat Prod (2020) 83: 2518-2527 [PMID:32786875] |
| Plasmodium berghei (target type: ORGANISM) [ChEMBL: CHEMBL612653] | ||||||||
| ChEMBL | Antimalarial activity against liver stages of Plasmodium berghei assessed as human HepG2 cells assessed as inhibition of hepatic parasite growth after invasion of hepatocytes incubated for 48 hrs followed by compound wash out measured after 2 days by RT-PCR analysis | F | 4.4 | pIC50 | 39400 | nM | IC50 | J Med Chem (2012) 55: 995-1012 [PMID:22122518] |
| ChEMBL | Antimalarial activity against liver stages of Plasmodium berghei infected in human HepG2 cells assessed as growth inhibition of hepatic parasite before invasion of hepatocytes incubated for 48 hrs followed by compound wash out measured after 3 days by RT-PCR analysis | F | 5.17 | pIC50 | 6800 | nM | IC50 | J Med Chem (2012) 55: 995-1012 [PMID:22122518] |
| Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364] | ||||||||
| ChEMBL | Antiparasitic activity against Plasmodium falciparum | F | 5.28 | pIC50 | 5210 | nM | IC50 | Bioorg Med Chem Lett (2010) 20: 5541-5543 [PMID:20692829] |
| Plasmodium yoelii (target type: ORGANISM) [ChEMBL: CHEMBL612889] | ||||||||
| ChEMBL | Antimalarial activity against liver stages of Plasmodium yoelii 17XNL expressing GFP infected in human HepG2 cells transfected with CD81 assessed as growth inhibition of hepatic parasite after 40 hrs by flow cytometry | F | 4.4 | pIC50 | 40000 | nM | IC50 | J Med Chem (2012) 55: 995-1012 [PMID:22122518] |
| Rhodesain in Trypanosoma brucei rhodesiense (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4188] [UniProtKB: Q95PM0] | ||||||||
| ChEMBL | Inhibition of Trypanosoma brucei rhodesiense rhodesain | B | 5.27 | pKi | 5310 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 5541-5543 [PMID:20692829] |
| Telomerase reverse transcriptase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2916] [UniProtKB: O14746] | ||||||||
| ChEMBL | Inhibition of telomerase in human SGC7901 cells by TRAP-PCR-ELISA | B | 6.3 | pIC50 | 500 | nM | IC50 | Medchemcomm (2011) 2: 229-245 |
| TRPA1/Transient receptor potential cation channel subfamily A member 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6007] [GtoPdb: 485] [UniProtKB: O75762] | ||||||||
| GtoPdb | - | - | 5.1 | pEC50 | 7943 | nM | EC50 | Proc Natl Acad Sci USA (2005) 102: 12248-52 [PMID:16103371] |
| ChEMBL | Activation of human TRPA1 channel | B | 5.72 | pEC50 | 1910 | nM | EC50 | J Med Chem (2010) 53: 5085-5107 [PMID:20356305] |
| TRPA1/Transient receptor potential cation channel subfamily A member 1 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075310] [GtoPdb: 485] [UniProtKB: Q8BLA8] | ||||||||
| ChEMBL | Activation of mouse TRPA1 channel | B | 5.88 | pEC50 | 1320 | nM | EC50 | J Med Chem (2010) 53: 5085-5107 [PMID:20356305] |
| GtoPdb | - | - | 5.9 | pEC50 | - | - | - | Curr Biol (2005) 15: 929-34 [PMID:15916949] |
| TRPV1/Vanilloid receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5102] [GtoPdb: 507] [UniProtKB: O35433] | ||||||||
| ChEMBL | Activation of rat TRPV1 channel | B | 4.29 | pEC50 | 51220 | nM | EC50 | J Med Chem (2010) 53: 5085-5107 [PMID:20356305] |
| GtoPdb | - | - | 4.6 | pEC50 | - | - | - | Curr Biol (2005) 15: 929-34 [PMID:15916949] |
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]
