Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 8/20 | 0.46 |
| ▸ | LCK | P06239 | 7/20 | 0.46 |
| ▸ | ITK | Q08881 | 7/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | TEC | P42680 | 1/20 | 0.43 |
| ▸ | TXK | P42681 | 1/20 | 0.43 |
| ▸ | BMX | P51813 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.43 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.43 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2370042 | 0.87 | AURKB (0.46) | AURKBLCKITKRAB9ANPC1 | |
| SCHEMBL2370005 | 0.85 | RAB9A (0.51) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL141266 | 0.82 | AURKB (0.51) | AURKBLCKITKRAB9ANPC1 | |
| SCHEMBL2370474 | 0.82 | MAPT (0.48) | RAB9ANPC1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2369950 | 0.79 | RAB9A (0.41) | LCKRAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL2370804 | 0.79 | ITK (0.62) | AURKBLCKITKRAB9ANPC1 | |
| SCHEMBL2370801 | 0.79 | ITK (0.62) | AURKBLCKITKRAB9ANPC1 | |
| SCHEMBL2370982 | 0.78 | RAB9A (0.53) | LCKRAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL2369553 | 0.77 | RAB9A (0.46) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2370319 | 0.76 | LMNA (0.42) | LCKRAB9ANPC1CYP1A2CYP3A4 |
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-2011110575-A1 | DERIVATIVES OF 2-[2-(BENZO- OR PYRIDO-) THIAZOLYLAMINO]-6-AMINOPYRIDINE, USEFUL IN THE TREATMENT OF RESPIRATORIC, ALLERGIC OR INFLAMMATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2011-09-15 | — | — | WO | disclosed |