Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.44 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | TBK1 | Q9UHD2 | 2/20 | 0.42 |
| ▸ | JAK2 | O60674 | 5/20 | 0.42 |
| ▸ | TYK2 | P29597 | 3/20 | 0.42 |
| ▸ | JAK1 | P23458 | 2/20 | 0.42 |
| ▸ | JAK3 | P52333 | 2/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.41 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.41 |
| ▸ | STK16 | O75716 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1633524 | 0.90 | JAK2 (0.50) | EGFRFGFR2TBK1JAK2TYK2 | |
| SCHEMBL1632155 | 0.89 | IKBKB (0.46) | EGFRMAPK10FGFR2CA12CA1 | |
| SCHEMBL13498247 | 0.87 | IKBKB (0.44) | EGFRFGFR2CA12CA1CA2 | |
| SCHEMBL1634505 | 0.87 | TBK1 (0.55) | MAPK10CA12CA1CA2CA9 | |
| SCHEMBL1633715 | 0.87 | NTRK1 (0.42) | MAPK10FGFR2TBK1TYK2MTOR | |
| SCHEMBL1631354 | 0.84 | TYK2 (0.54) | EGFRCA12CA1CA2CA9 | |
| SCHEMBL1632740 | 0.82 | CYP11B2 (0.42) | EGFRCA12CA1CA2CA9 | |
| SCHEMBL1632623 | 0.80 | MAPK10 (0.53) | EGFRMAPK10JAK2MTORSMG1 | |
| SCHEMBL13498295 | 0.78 | MTOR (0.62) | EGFRMAPK10CA12CA1CA2 | |
| SCHEMBL1633768 | 0.78 | PTK2 (0.45) | MAPK10CA12CA1CA2CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |