Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.56 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.49 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.48 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.48 |
| ▸ | SYK | P43405 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 5/20 | 0.47 |
| ▸ | JAK3 | P52333 | 3/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.46 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.44 |
| ▸ | CDK1 | P06493 | 3/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 3/20 | 0.44 |
| ▸ | CDK7 | P50613 | 3/20 | 0.44 |
| ▸ | CDK9 | P50750 | 3/20 | 0.44 |
| ▸ | CCNH | P51946 | 3/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10080358 | 0.91 | TBK1 (0.58) | TBK1MTORSMG1STK17ASYK | |
| SCHEMBL434437 | 0.85 | TBK1 (0.61) | TBK1MTORSMG1STK17ASYK | |
| SCHEMBL10081571 | 0.85 | ABL1 (0.59) | TBK1MTORSMG1STK17AJAK2 | |
| SCHEMBL431866 | 0.84 | TBK1 (0.61) | TBK1MTORSMG1STK17ASYK | |
| SCHEMBL432527 | 0.81 | JAK2 (0.65) | TBK1MTORSMG1STK17AJAK2 | |
| SCHEMBL432714 | 0.81 | CDC7 (0.59) | TBK1STK17AJAK2JAK3CSNK2A1 | |
| SCHEMBL460899 | 0.81 | TBK1 (0.60) | TBK1MTORSMG1STK17AJAK2 | |
| SCHEMBL29932219 | 0.81 | TBK1 (0.60) | TBK1MTORSMG1STK17AJAK2 | |
| SCHEMBL4378275 | 0.81 | JAK2 (0.61) | MTORSMG1DYRK2SYKJAK2 | |
| SCHEMBL432429 | 0.79 | CDK2 (0.57) | TBK1STK17AJAK2JAK3NTRK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103119025-B | Pyrimidine compounds as inhibitors of protein kinase IKK and/or TBK-1, processes for their preparation, and pharmaceutical compositions containing them | DOMAINEX LTD. (GB) | 2015-09-09 | — | — | CN | disclosed |