Assay Detail
Binding
CHEMBL5729998
Review assay metadata, readout intent, target linkage, and publication context from the same page.
In Vitro Cell-Free Assay: Test compounds in aqueous solution were added at a volume of 10 microliters, to a reaction mixture comprising 10 microliters Assay Dilution Buffer (ADB; 20 mM MOPS, pH 7.2, 25 mM beta-glycerolphosphate, 5 mM EGTA, 1 mM sodium orthovanadate and 1 mM dithiothreitol), 10 microliters of substrate peptide (RRRDDDSDDD, dissolved in ADB at a concentration of 1 mM), 10 microliters of recombinant human CK2 (25 ng dissolved in ADB; Upstate). Reactions were initiated by the addition of 10 microliters of ATP Solution (90% 75 mM MgCl2, 75 micromolar ATP dissolved in ADB; 10% [gamma-33P]ATP (stock 1 mCi/100 ul; 3000 Ci/mmol (Perkin Elmer) and maintained for 10 minutes at 30 degrees C. The reactions were quenched with 100 microliters of 0.75% phosphoric acid, then transferred to and filtered through a phosphocellulose filter plate (Millipore). After washing each well 5 times with 0.75% phosphoric acid, the plate was dried under vacuum for 5 min.
948
Total Activities
234
Compounds Tested
3
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Fused tricyclic compounds as serine-threonine protein kinase and PARP modulators
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 316 | 6.82 | 8.70 |
| kon | 316 | - | - |
| k_off | 316 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1230165 | SILMITASERTIB | 2.0 | 3 | 8.70 |
| CHEMBL1652704 | — | — | 3 | 8.52 |
| CHEMBL1652737 | — | — | 3 | 8.52 |
| CHEMBL1652706 | — | — | 6 | 8.40 |
| CHEMBL1652707 | — | — | 6 | 8.40 |
| CHEMBL1652738 | — | — | 3 | 8.40 |
| CHEMBL1682287 | — | — | 3 | 8.40 |
| CHEMBL1652708 | — | — | 3 | 8.30 |
| CHEMBL3700416 | — | — | 3 | 8.30 |
| CHEMBL3700418 | — | — | 3 | 8.30 |
| CHEMBL3700457 | — | — | 3 | 8.22 |
| CHEMBL3700453 | — | — | 3 | 8.22 |
| CHEMBL1682283 | — | — | 3 | 8.22 |
| CHEMBL1682281 | — | — | 3 | 8.22 |
| CHEMBL1652697 | — | — | 9 | 8.22 |
| CHEMBL1682282 | — | — | 3 | 8.22 |
| CHEMBL1649770 | — | — | 3 | 8.15 |
| CHEMBL1652710 | — | — | 3 | 8.15 |
| CHEMBL3700417 | — | — | 3 | 8.15 |
| CHEMBL3700437 | — | — | 3 | 8.15 |
| CHEMBL3700434 | — | — | 3 | 8.05 |
| CHEMBL1682297 | — | — | 6 | 8.05 |
| CHEMBL1652703 | — | — | 3 | 8.05 |
| CHEMBL1682280 | — | — | 3 | 8.00 |
| CHEMBL3700482 | — | — | 3 | 8.00 |
| CHEMBL1682285 | — | — | 3 | 7.96 |
| CHEMBL3700458 | — | — | 3 | 7.96 |
| CHEMBL1682292 | — | — | 3 | 7.89 |
| CHEMBL3700477 | — | — | 3 | 7.85 |
| CHEMBL3700480 | — | — | 3 | 7.85 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1230165 | SILMITASERTIB | IC50 | = | 2.0 | nM | 8.70 |
| CHEMBL1652704 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL1652737 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL1652706 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL1652707 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL1682287 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL1652738 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL1652708 | — | IC50 | = | 5.0 | nM | 8.30 |
| CHEMBL3700418 | — | IC50 | = | 5.0 | nM | 8.30 |
| CHEMBL3700416 | — | IC50 | = | 5.0 | nM | 8.30 |
| CHEMBL3700453 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1682283 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1682282 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1682281 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL3700457 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1652697 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1652707 | — | IC50 | = | 6.0 | nM | 8.22 |
| CHEMBL1652706 | — | IC50 | = | 7.0 | nM | 8.15 |
| CHEMBL3700417 | — | IC50 | = | 7.0 | nM | 8.15 |
| CHEMBL1649770 | — | IC50 | = | 7.0 | nM | 8.15 |
| CHEMBL3700437 | — | IC50 | = | 7.0 | nM | 8.15 |
| CHEMBL1652710 | — | IC50 | = | 7.0 | nM | 8.15 |
| CHEMBL3700434 | — | IC50 | = | 9.0 | nM | 8.05 |
| CHEMBL1682297 | — | IC50 | = | 9.0 | nM | 8.05 |
| CHEMBL1652703 | — | IC50 | = | 9.0 | nM | 8.05 |
| CHEMBL3700482 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL1682280 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL1652697 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL3700458 | — | IC50 | = | 11.0 | nM | 7.96 |
| CHEMBL1682285 | — | IC50 | = | 11.0 | nM | 7.96 |
| CHEMBL1652697 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL1682292 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL3700480 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL3700477 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL3700476 | — | IC50 | = | 15.0 | nM | 7.82 |
| CHEMBL1652701 | — | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL1652705 | — | IC50 | = | 16.0 | nM | 7.80 |
| CHEMBL3700435 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL3700461 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL1682288 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL3700415 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL1652698 | — | IC50 | = | 19.0 | nM | 7.72 |
| CHEMBL3700415 | — | IC50 | = | 19.0 | nM | 7.72 |
| CHEMBL3700436 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL3700424 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL3700485 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL3700450 | — | IC50 | = | 21.0 | nM | 7.68 |
| CHEMBL3700475 | — | IC50 | = | 23.0 | nM | 7.64 |
| CHEMBL1652698 | — | IC50 | = | 25.0 | nM | 7.60 |
| CHEMBL3700425 | — | IC50 | = | 26.0 | nM | 7.58 |