Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 5/20 | 0.39 |
| ▸ | ITK | Q08881 | 2/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | HCK | P08631 | 2/20 | 0.37 |
| ▸ | BTK | Q06187 | 2/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL807804 | 0.82 | LCK (0.46) | LCKITKAURKBRORCDHODH | |
| SCHEMBL10285615 | 0.80 | LCK (0.40) | LCKITKAURKBRORCDHODH | |
| SCHEMBL807713 | 0.77 | ITK (0.41) | LCKITKAURKBRORCDHODH | |
| SCHEMBL808049 | 0.76 | LCK (0.43) | LCKRORCDHODHHCKBTK | |
| SCHEMBL10286653 | 0.76 | HCK (0.44) | LCKITKAURKBRORCDHODH | |
| SCHEMBL139140 | 0.74 | LCK (0.70) | LCKITKAURKBRORCDHODH | |
| SCHEMBL139139 | 0.74 | LCK (0.70) | LCKITKAURKBRORCDHODH | |
| SCHEMBL807541 | 0.72 | ITK (0.55) | LCKITKAURKBRORCDHODH | |
| SCHEMBL807926 | 0.71 | ITK (0.59) | LCKITKAURKBRORCDHODH | |
| SCHEMBL111924 | 0.69 | AURKB (0.55) | LCKITKAURKBRORCDHODH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012035055-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-22 | — | — | WO | disclosed |