Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 2/20 | 0.40 |
| ▸ | BRAF | P15056 | 3/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 6/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12725036 | 0.91 | MAP3K5 (0.39) | MAP3K5BRAFMAP4K1SYKROCK2 | |
| SCHEMBL1632123 | 0.90 | MAP3K5 (0.44) | MAP3K5BRAFMAP4K1SYKPTK2 | |
| SCHEMBL1632182 | 0.82 | MAP4K1 (0.49) | MAP3K5BRAFMAP4K1SYKROCK2 | |
| SCHEMBL1633882 | 0.81 | SYK (0.47) | SYKPTK2JAK2JAK1TYK2 | |
| SCHEMBL12725033 | 0.81 | MAP3K5 (0.44) | MAP3K5BRAFMAP4K1SYKROCK2 | |
| SCHEMBL1632924 | 0.79 | PRKCZ (0.39) | SYKJAK2JAK1TYK2JAK3 | |
| SCHEMBL1633716 | 0.79 | PRKCZ (0.38) | SYKPTK2JAK2JAK1TYK2 | |
| SCHEMBL13336105 | 0.77 | BRAF (0.48) | BRAFSYKPRKCZROCK1IKBKB | |
| SCHEMBL13336156 | 0.77 | BRAF (0.41) | BRAFMAP4K1SYKPTK2JAK2 | |
| SCHEMBL13336057 | 0.77 | BRAF (0.41) | BRAFMAP4K1SYKJAK2JAK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7932262-B2 | Quinazolines for PDK1 inhibition | NOVARTIS AG (CH) | 2011-04-26 | — | — | US | disclosed |