Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | ITK | Q08881 | 2/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TYK2 | P29597 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10285818 | 0.85 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL798710 | 0.80 | LCK (0.45) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL2370127 | 0.80 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL2370061 | 0.80 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL2370507 | 0.79 | ITK (0.66) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL2370517 | 0.79 | ITK (0.66) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL2370005 | 0.74 | RAB9A (0.51) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL139226 | 0.72 | ITK (0.64) | NPC1RAB9ASMN1; SMN2ITKLCK | |
| SCHEMBL140356 | 0.69 | ITK (0.80) | ITKLCKAURKBPOLB | |
| SCHEMBL140357 | 0.69 | ITK (0.80) | ITKLCKAURKBPOLB |
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 |