Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 6/20 | 0.38 |
| ▸ | JAK3 | P52333 | 6/20 | 0.38 |
| ▸ | PLK4 | O00444 | 3/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 9/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | JAK1 | P23458 | 3/20 | 0.36 |
| ▸ | TYK2 | P29597 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.35 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.35 |
| ▸ | NTRK2 | Q16620 | 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 | |
|---|---|---|---|---|
| SCHEMBL3973293 | 0.82 | JAK2 (0.39) | JAK2JAK3PLK4NTRK1CYP3A4 | |
| SCHEMBL3966806 | 0.77 | JAK2 (0.41) | JAK2JAK3PLK4NTRK1CYP3A4 | |
| SCHEMBL3972231 | 0.71 | AURKA (0.41) | JAK2JAK3NTRK1CYP3A4NTRK3 | |
| SCHEMBL3967892 | 0.66 | JAK2 (0.41) | JAK2JAK3PLK4NTRK1JAK1 | |
| SCHEMBL3964062 | 0.65 | NTRK1 (0.45) | JAK2JAK3PLK4NTRK1CYP2C19 | |
| SCHEMBL3972216 | 0.64 | SYK (0.46) | PLK4NTRK1TNIKPAK4 | |
| SCHEMBL3972285 | 0.64 | CCNA2 (0.45) | PLK4NTRK1PAK4 | |
| SCHEMBL3969898 | 0.64 | SYK (0.43) | PLK4TNIKPAK4 | |
| SCHEMBL3969123 | 0.63 | JAK2 (0.40) | JAK2JAK3PLK4NTRK1JAK1 | |
| SCHEMBL3972230 | 0.63 | AURKA (0.38) | JAK2JAK3PLK4 |
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-2007071348-A1 | ISOQUINOLINE AMINOPYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2007-06-28 | — | — | WO | disclosed |