Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 2/20 | 0.54 |
| ▸ | BRD4 | O60885 | 2/20 | 0.54 |
| ▸ | JAK1 | P23458 | 1/20 | 0.53 |
| ▸ | BRD2 | P25440 | 1/20 | 0.53 |
| ▸ | JAK3 | P52333 | 1/20 | 0.53 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.53 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17552273 | 1.00 | JAK2 (0.54) | JAK2BRD4JAK1BRD2JAK3 | |
| SCHEMBL18863130 | 0.85 | JAK2 (0.55) | JAK2BRD4 | |
| SCHEMBL17552263 | 0.85 | TAAR1 (0.55) | — | |
| SCHEMBL20053857 | 0.85 | TAAR1 (0.55) | — | |
| SCHEMBL20053846 | 0.84 | — | — | |
| SCHEMBL17552261 | 0.84 | — | — | |
| SCHEMBL18863140 | 0.82 | — | — | |
| SCHEMBL17552247 | 0.82 | — | — | |
| SCHEMBL17552308 | 0.80 | TAAR1 (0.59) | — | |
| SCHEMBL20053856 | 0.80 | TAAR1 (0.59) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3186250-B1 | SUBSTITUTED PYRAZINO[2,1-A]ISOQUINOLINE DERIVATIVES FOR THE TREATMENT OF CNS DISORDERS | HOFFMANN LA ROCHE (CH) | 2018-04-18 | — | — | EP | disclosed |