Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 7/20 | 0.42 |
| ▸ | PTK2 | Q05397 | 7/20 | 0.42 |
| ▸ | JAK3 | P52333 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | GLS | O94925 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CRACR2A | Q9BSW2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2788358 | 0.77 | JAK2 (0.51) | HRH3SIGMAR1JAK2ADORA3ADORA2A | |
| SCHEMBL23972940 | 0.73 | EPHX2 (0.68) | SIGMAR1CYP1A2CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL12726019 | 0.69 | SIGMAR1 (0.68) | HRH3SIGMAR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3702539 | 0.64 | KCNQ3 (0.52) | JAK2JAK3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10211633 | 0.64 | SIGMAR1 (0.60) | HRH3SIGMAR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL362394 | 0.63 | ALDH1A1 (0.66) | CYP1A2CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL21325659 | 0.62 | GLS (0.67) | GLSALDH1A1 | |
| SCHEMBL18861429 | 0.62 | GLS (0.54) | HRH3SIGMAR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL14368710 | 0.62 | SIGMAR1 (0.55) | HRH3SIGMAR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL27757306 | 0.62 | SIGMAR1 (0.55) | HRH3SIGMAR1CYP1A2CYP3A4CYP2C9 |
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-8263595-B2 | Triazolopyridine compounds and their use as ask inhibitors | MERCK SERONO SA (CH) | 2012-09-11 | — | — | US | claimed |