Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10055429 | 0.86 | CYP2C9 (0.50) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10057404 | 0.85 | CYP2C19 (0.55) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10057425 | 0.82 | CYP2C9 (0.59) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10055708 | 0.82 | CYP2C9 (0.55) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL15044220 | 0.82 | CYP2C19 (0.58) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10055383 | 0.81 | CYP2C9 (0.54) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10057406 | 0.81 | CYP2C9 (0.57) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10055513 | 0.79 | CYP2C9 (0.51) | CYP2C19CYP2C9MEN1KMT2AHPGD | |
| SCHEMBL10055319 | 0.79 | CYP2C9 (0.48) | CYP2C19CYP2C9MEN1KMT2ARAB9A | |
| SCHEMBL15043962 | 0.76 | CYP2C19 (0.62) | CYP2C19CYP2C9MEN1KMT2AHPGD |
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-2012020749-A1 | TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY | 塩野義製薬株式会社 (JP) | 2012-02-16 | — | — | WO | disclosed |