Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | FLT4 | P35916 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | FRK | P42685 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5697493 | 0.79 | MRGPRX1 (0.45) | MRGPRX1MMP2MMP3MMP9MMP14 | |
| SCHEMBL5697484 | 0.77 | LTA4H (0.46) | MAPTKDM4E | |
| SCHEMBL1680332 | 0.77 | VEGFA (0.38) | MRGPRX1MMP2MMP3MMP9MMP14 | |
| SCHEMBL12351789 | 0.76 | MRGPRX1 (0.36) | MRGPRX1MMP2MMP3MMP9MMP14 | |
| SCHEMBL1680329 | 0.76 | MAOB (0.39) | MRGPRX1MMP2MMP3MMP9MMP14 | |
| SCHEMBL5697486 | 0.76 | PDE4A (0.39) | MAP4K4SLC6A2SLC6A4SLC6A3EPAS1 | |
| SCHEMBL7938427 | 0.74 | MAPT (0.46) | MMP2MMP3MMP9MMP14MAP4K4 | |
| SCHEMBL4148474 | 0.73 | CDK1 (0.54) | MRGPRX1MAP4K4CDC7DYRK3ROCK2 | |
| SCHEMBL6290410 | 0.72 | ALDH1A1 (0.50) | MMP2MMP3MMP9MMP14MAP4K4 | |
| SCHEMBL6293197 | 0.72 | ALDH1A1 (0.50) | MMP2MMP3MMP9MMP14MAP4K4 |
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-1669348-A1 | NOVEL ANTIFUNGAL AGENT COMPRISING HETEROCYCLIC COMPOUND | Eisai Co., Ltd. (JP) | 2006-06-14 | — | — | EP | disclosed |