αβ-methyleneADP [Ligand Id: 5092] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL583969 |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Ecto-5'-Nucleotidase/5`-nucleotidase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5957] [GtoPdb: 1232] [UniProtKB: P21589] | ||||||||
| ChEMBL | Inhibition of CD73 in human melanoma 1539 cells using AMP substrate by capillary electrophoresis assay | B | 6.29 | pKi | 510 | nM | Ki | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| ChEMBL | Inhibition of native CD73 in human MDA-MB-231 cell membrane preparations [3H]AMP as substrate incubated for 25 mins by scintillation counting method | B | 6.68 | pKi | 207 | nM | Ki | J Med Chem (2020) 63: 2941-2957 [PMID:32045236] |
| ChEMBL | Inhibition of purified recombinant soluble human CD73 expressed in Sf9 cells [3H]AMP as substrate incubated for 25 mins by scintillation counting method | B | 7.05 | pKi | 88.4 | nM | Ki | J Med Chem (2020) 63: 2941-2957 [PMID:32045236] |
| ChEMBL | Inhibition of human CD73 | B | 7.05 | pKi | 88.4 | nM | Ki | J Med Chem (2020) 63: 3935-3955 [PMID:32212732] |
| ChEMBL | Inhibition of human CD73 using AMP as substrate by Malachite green phosphate reagent-based assay | B | 7.05 | pKi | 88.4 | nM | Ki | J Med Chem (2020) 63: 11448-11468 [PMID:32614585] |
| ChEMBL | Inhibition of human recombinant soluble CD73 assessed as inhibition constant by radiometric assay | B | 7.05 | pKi | 88.4 | nM | Ki | J Med Chem (2022) 65: 2409-2433 [PMID:35080883] |
| ChEMBL | Inhibition of CD73 in human NCI-H292 cells assessed as reduction in conversion of AMP to adenosine incubated for 30 mins by malachite green reagent based assay | B | 4.63 | pIC50 | 23600 | nM | IC50 | Eur J Med Chem (2018) 157: 1051-1055 [PMID:30176535] |
| ChEMBL | Inhibition of CD73 in human MDA-MB-231 cells assessed as reduction in conversion of AMP to adenosine incubated for 30 mins by malachite green reagent based assay | B | 4.67 | pIC50 | 21400 | nM | IC50 | Eur J Med Chem (2018) 157: 1051-1055 [PMID:30176535] |
| ChEMBL | Inhibition of human CD73 | B | 5.4 | pIC50 | 3970 | nM | IC50 | Bioorg Med Chem Lett (2021) 34: 127758-127758 [PMID:33359608] |
| ChEMBL | Inhibition of recombinant CD73 (27 to 549 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells assessed as reduction in conversion of AMP to adenosine incubated for 1 min followed by AMP addition measured after 3.5 mins by malachite green reagent based assay | B | 5.42 | pIC50 | 3800 | nM | IC50 | Eur J Med Chem (2018) 157: 1051-1055 [PMID:30176535] |
| ChEMBL | Inhibition of human C-terminal His6-tagged CD73 expressed in CHO cells preincubated for 15 mins followed by AMP addition and measured after 10 mins by malachite green reagent based assay | B | 5.58 | pIC50 | 2653 | nM | IC50 | J Med Chem (2020) 63: 10433-10459 [PMID:32865411] |
| ChEMBL | Inhibition of recombinant human CD73 using AMP as substrate incubated for 120 mins by CellTiter-Glo assay | B | 5.6 | pIC50 | 2500 | nM | IC50 | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| ChEMBL | Inhibition of recombinant human CD73 using AMP as substrate incubated for 90 mins by malachite green colorimetric assay | B | 5.96 | pIC50 | 1100 | nM | IC50 | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| ChEMBL | Inhibition of human CD73 using AMP as substrate by Malachite green phosphate reagent-based assay | B | 6.73 | pIC50 | 187 | nM | IC50 | J Med Chem (2020) 63: 11448-11468 [PMID:32614585] |
| ChEMBL | Inhibition of human C-terminal His6-tagged CD73 expressed in HEK293F cells using [15N]5-AMP as substrate preincubated for 1 hr followed by substrate addition and measured after 8 mins by MS/MS assay | B | 7.22 | pIC50 | 60 | nM | IC50 | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| ChEMBL | Inhibition of human CD73 expressed in CHO cells using AMP as substrate preincubated for 10 mins followed by substrate addition and measured every minute for 10 to 20 mins by PNP coupled enzyme assay | B | 7.3 | pIC50 | 50 | nM | IC50 | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| GtoPdb | - | - | 8.7 | pIC50 | - | - | - | Biochemistry (1975) 14: 2362-6 [PMID:1169962] |
| ChEMBL | Inhibition of CD73 in human NCI-H1568 cells assessed as reduction in AMP-induced ADO expression preincubated for 15 mins followed by AMP addition and measured after 1 hr by LC-MS/MS analysis | B | 4.79 | pEC50 | 16268 | nM | EC50 | J Med Chem (2020) 63: 10433-10459 [PMID:32865411] |
| Ecto-5'-Nucleotidase/5`-nucleotidase in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4680034] [GtoPdb: 1232] [UniProtKB: Q61503] | ||||||||
| ChEMBL | Inhibition of mouse CD73 | B | 5.33 | pIC50 | 4630 | nM | IC50 | Bioorg Med Chem Lett (2021) 34: 127758-127758 [PMID:33359608] |
| Ecto-5'-Nucleotidase/5`-nucleotidase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075214] [GtoPdb: 1232] [UniProtKB: P21588] | ||||||||
| ChEMBL | Inhibition of rat CD73 expressed in baculovirus infected insect cells using AMP substrate by capillary electrophoresis assay | B | 6.06 | pKi | 870 | nM | Ki | J Med Chem (2020) 63: 13444-13465 [PMID:32786396] |
| ChEMBL | Inhibition of purified recombinant soluble rat CD73 expressed in Sf9 cells [3H]AMP as substrate incubated for 25 mins by scintillation counting method | B | 6.71 | pKi | 197 | nM | Ki | J Med Chem (2020) 63: 2941-2957 [PMID:32045236] |
| ChEMBL | Inhibition of recombinant rat C-terminal His-tagged soluble form of CD73 expressed in baculovirus infected Sf9 insect cells using [2,8-3H]AMP as substrate measured after 25 mins by scintillation counting method | B | 6.78 | pKi | 167 | nM | Ki | J Med Chem (2019) 62: 3677-3695 [PMID:30895781] |
| ectonucleoside triphosphate diphosphohydrolase 1/Ectonucleoside triphosphate diphosphohydrolase 1 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4739681] [GtoPdb: 2888] [UniProtKB: P55772] | ||||||||
| ChEMBL | Inhibition of mouse CD39 | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2021) 34: 127758-127758 [PMID:33359608] |
| Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5925] [UniProtKB: P22413] | ||||||||
| ChEMBL | Competitive-inhibition of recombinant human N-terminal His-tagged soluble NPP1 (Val191 to Leu591 residues) expressed in mouse NSO cells using p-Nph-5'-AMP as substrate after 30 mins by capillary electrophoresis method | B | 4.59 | pKi | 25800 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
| ChEMBL | Competitive-inhibition of recombinant human N-terminal His-tagged soluble NPP1 (Val191 to Leu591 residues) expressed in mouse NSO cells using ATP as substrate after 30 mins by capillary electrophoresis method | B | 4.61 | pKi | 24300 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
| ChEMBL | Competitive-inhibition of recombinant human N-terminal His-tagged soluble NPP1 (Val191 to Leu591 residues) expressed in mouse NSO cells using ATP as substrate by capillary electrophoresis method | B | 4.78 | pKi | 16500 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
| ChEMBL | Competitive-inhibition of recombinant human NPP1 expressed in HEK293 cell membranes using p-Nph-5'-TMP as substrate pretreated for 10 mins followed by substrate addition and measured after 60 mins by capillary electrophoresis method | B | 4.78 | pKi | 16500 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
| ChEMBL | Competitive-inhibition of recombinant human N-terminal His-tagged soluble NPP1 (Val191 to Leu591 residues) expressed in mouse NSO cells using p-Nph-5'-TMP as substrate after 15 mins by capillary electrophoresis method | B | 5.89 | pKi | 1280 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
| Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4295913] [UniProtKB: Q924C3] | ||||||||
| ChEMBL | Mixed-inhibition of Wistar rat NPP1 using p-Nph-5'-TMP as substrate measured after 5 mins by UPLC method | B | 5.02 | pKi | 9600 | nM | Ki | Medchemcomm (2017) 8: 823-840 [PMID:30108800] |
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]
