Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 9/20 | 0.47 |
| ▸ | NTRK3 | Q16288 | 2/20 | 0.47 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.47 |
| ▸ | AURKA | O14965 | 4/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | PLK4 | O00444 | 2/20 | 0.42 |
| ▸ | PAK4 | O96013 | 2/20 | 0.42 |
| ▸ | JAK2 | O60674 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | JAK1 | P23458 | 3/20 | 0.41 |
| ▸ | TYK2 | P29597 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | JAK3 | P52333 | 3/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL174435 | 0.84 | AURKA (0.50) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL14432796 | 0.84 | AURKA (0.45) | NTRK1NTRK3NTRK2AURKAAURKB | |
| Hydrochloric Acid SCHEMBL174764 | 0.83 | AURKA (0.49) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL3765074 | 0.82 | DHODH (0.45) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL174948 | 0.81 | SYK (0.42) | NTRK1AURKAAURKBPLK4PAK4 | |
| SCHEMBL17666782 | 0.81 | NTRK1 (0.61) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL17501774 | 0.79 | AURKA (0.53) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL174676 | 0.79 | PLK4 (0.45) | NTRK1AURKAAURKBPLK4PAK4 | |
| SCHEMBL174782 | 0.76 | NTRK1 (0.47) | NTRK1NTRK3NTRK2AURKAAURKB | |
| SCHEMBL12487501 | 0.76 | AURKA (0.49) | NTRK1AURKAPAK4JAK1 |
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-8349851-B2 | JAK kinase modulating compounds and methods of use thereof | AMBIT BIOSCIENCES CORP. (US) | 2013-01-08 | — | — | US | claimed |