Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 4/20 | 0.61 |
| ▸ | TNNI3K | Q59H18 | 4/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.50 |
| ▸ | EGFR | P00533 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1804510 | 0.99 | BRAF (0.60) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1805724 | 0.96 | BRAF (0.63) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1807903 | 0.96 | BRAF (0.63) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1804741 | 0.94 | BRAF (0.55) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1806081 | 0.94 | BRAF (0.64) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1805541 | 0.94 | BRAF (0.54) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1808229 | 0.93 | BRAF (0.53) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1806484 | 0.92 | TNNI3K (0.58) | BRAFTNNI3KMAPK1ALDH1A1HTT | |
| SCHEMBL1806487 | 0.91 | BRAF (0.51) | BRAFTNNI3KMAPK1KMT2AEGFR | |
| SCHEMBL1806390 | 0.90 | MAPK1 (0.54) | BRAFTNNI3KMAPK1ALDH1A1HTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2501233-A1 | QUINAZOLINE COMPOUNDS | GlaxoSmithKline LLC (US) | 2012-09-26 | — | — | EP | claimed |
| WO-2011056740-A1 | QUINAZOLINE COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2011-05-12 | — | — | WO | claimed |
| EP-2501233-A1 | QUINAZOLINE COMPOUNDS | GlaxoSmithKline LLC (US) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011056740-A1 | QUINAZOLINE COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2011-05-12 | — | — | WO | disclosed |