Assay Detail
Functional
CHEMBL681824
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibitory activity, for stimulation of TNF-alpha release in gamma-delta T cells, using a constrained maximum TNF-alpha release of 2700 pg/mL
61
Total Activities
61
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Organism | Homo sapiens |
| Cell Type | T-cell |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Quantitative structure-activity relationships for gammadelta T cell activation by bisphosphonates.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 61 | 4.66 | 5.31 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL55140 | — | — | 1 | 5.31 |
| CHEMBL434024 | — | — | 1 | 5.25 |
| CHEMBL923 | RISEDRONIC ACID | 4.0 | 1 | 5.21 |
| CHEMBL340034 | — | — | 1 | 5.14 |
| CHEMBL319144 | MINODRONIC ACID | 4.0 | 1 | 5.10 |
| CHEMBL98110 | — | — | 1 | 5.00 |
| CHEMBL301247 | — | — | 1 | 4.92 |
| CHEMBL54472 | N-(HEXAMETHYLENEIMINO)METHYLENEBISPHOSPHONIC ACID | — | 1 | 4.89 |
| CHEMBL55608 | (BUTYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.89 |
| CHEMBL55557 | — | — | 1 | 4.85 |
| CHEMBL294192 | — | — | 1 | 4.85 |
| CHEMBL53950 | INCADRONIC ACID | 2.0 | 1 | 4.82 |
| CHEMBL294191 | — | — | 1 | 4.80 |
| CHEMBL125887 | — | — | 1 | 4.80 |
| CHEMBL291736 | — | — | 1 | 4.80 |
| CHEMBL56011 | — | — | 1 | 4.72 |
| CHEMBL55886 | — | — | 1 | 4.68 |
| CHEMBL301244 | — | — | 1 | 4.64 |
| CHEMBL125461 | — | — | 1 | 4.62 |
| CHEMBL301065 | — | — | 1 | 4.62 |
| CHEMBL55959 | — | — | 1 | 4.55 |
| CHEMBL997 | IBANDRONIC ACID | 4.0 | 1 | 4.51 |
| CHEMBL299717 | (PROPYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.46 |
| CHEMBL56255 | (PENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.39 |
| CHEMBL55856 | (ISOPENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.33 |
| CHEMBL56253 | (CYCLOHEXYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.33 |
| CHEMBL870 | ALENDRONIC ACID | 4.0 | 1 | 4.28 |
| CHEMBL58830 | (CYCLOPENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | — | 1 | 4.26 |
| CHEMBL124647 | — | — | 1 | 4.20 |
| CHEMBL124796 | — | — | 1 | 4.17 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL55140 | — | IC50 | = | 4900.0 | nM | 5.31 |
| CHEMBL434024 | — | IC50 | = | 5600.0 | nM | 5.25 |
| CHEMBL923 | RISEDRONIC ACID | IC50 | = | 6200.0 | nM | 5.21 |
| CHEMBL340034 | — | IC50 | = | 7300.0 | nM | 5.14 |
| CHEMBL319144 | MINODRONIC ACID | IC50 | = | 8000.0 | nM | 5.10 |
| CHEMBL98110 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL301247 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL54472 | N-(HEXAMETHYLENEIMINO)METHYLENEBISPHOSPHONIC ACID | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL55608 | (BUTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL55557 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL294192 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL53950 | INCADRONIC ACID | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL125887 | — | IC50 | = | 16000.0 | nM | 4.80 |
| CHEMBL291736 | — | IC50 | = | 16000.0 | nM | 4.80 |
| CHEMBL294191 | — | IC50 | = | 16000.0 | nM | 4.80 |
| CHEMBL56011 | — | IC50 | = | 19000.0 | nM | 4.72 |
| CHEMBL55886 | — | IC50 | = | 21000.0 | nM | 4.68 |
| CHEMBL301244 | — | IC50 | = | 23000.0 | nM | 4.64 |
| CHEMBL125461 | — | IC50 | = | 24000.0 | nM | 4.62 |
| CHEMBL301065 | — | IC50 | = | 24000.0 | nM | 4.62 |
| CHEMBL55959 | — | IC50 | = | 28000.0 | nM | 4.55 |
| CHEMBL997 | IBANDRONIC ACID | IC50 | = | 31000.0 | nM | 4.51 |
| CHEMBL299717 | (PROPYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 35000.0 | nM | 4.46 |
| CHEMBL56255 | (PENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 41000.0 | nM | 4.39 |
| CHEMBL56253 | (CYCLOHEXYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 47000.0 | nM | 4.33 |
| CHEMBL55856 | (ISOPENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 47000.0 | nM | 4.33 |
| CHEMBL870 | ALENDRONIC ACID | IC50 | = | 52000.0 | nM | 4.28 |
| CHEMBL58830 | (CYCLOPENTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 55000.0 | nM | 4.26 |
| CHEMBL124647 | — | IC50 | = | 63000.0 | nM | 4.20 |
| CHEMBL124796 | — | IC50 | = | 67000.0 | nM | 4.17 |
| CHEMBL331016 | N-(HEPTAMETHYLENEIMINO)METHYLENEBISPHOSPHONIC ACID | IC50 | = | 68000.0 | nM | 4.17 |
| CHEMBL125706 | — | IC50 | = | 72000.0 | nM | 4.14 |
| CHEMBL55352 | (DIPROPYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 83000.0 | nM | 4.08 |
| CHEMBL125188 | — | IC50 | = | 110000.0 | nM | - |
| CHEMBL127801 | — | IC50 | = | 348000.0 | nM | - |
| CHEMBL127186 | — | IC50 | = | 1648000.0 | nM | - |
| CHEMBL412889 | (CYCLOOCTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 110000.0 | nM | - |
| CHEMBL124324 | — | IC50 | = | 400000.0 | nM | - |
| CHEMBL54926 | (CYCLOBUTYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 127000.0 | nM | - |
| CHEMBL338622 | — | IC50 | = | 2070000.0 | nM | - |
| CHEMBL55214 | NERIDRONIC ACID | IC50 | = | 503000.0 | nM | - |
| CHEMBL417932 | — | IC50 | = | 19939000.0 | nM | - |
| CHEMBL127588 | — | IC50 | = | 9015000.0 | nM | - |
| CHEMBL338917 | — | IC50 | = | 2741000.0 | nM | - |
| CHEMBL298771 | — | IC50 | = | 213000.0 | nM | - |
| CHEMBL299563 | THIOMORPHOLINOMETHYLENEDIPHOSPHONIC ACID | IC50 | = | 597000.0 | nM | - |
| CHEMBL834 | PAMIDRONIC ACID | IC50 | = | 941000.0 | nM | - |
| CHEMBL340090 | — | IC50 | = | 103000.0 | nM | - |
| CHEMBL55358 | — | IC50 | = | 110000.0 | nM | - |
| CHEMBL417549 | (NONYLAMINO)METHYLENEDIPHOSPHONIC ACID | IC50 | = | 169000.0 | nM | - |