Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5733339 | 0.88 | HTR2A (0.34) | HTR2ACYP1A2ALOX5CYP2A6PYCR1 | |
| SCHEMBL21224379 | 0.88 | HTR2A (0.34) | HTR2ACYP1A2ALOX5CYP2A6PYCR1 | |
| SCHEMBL27878321 | 0.82 | HTR2A (0.39) | HTR2ACYP1A2ALOX5CYP2A6KMT2A | |
| SCHEMBL651743 | 0.80 | TSHR (0.44) | CYP1A2CYP2A6KMT2AMEN1 | |
| SCHEMBL3838715 | 0.80 | HTR2A (0.38) | HTR2ACYP1A2ALOX5CYP2A6PYCR1 | |
| SCHEMBL6683976 | 0.78 | PYCR1 (0.38) | HTR2ACYP1A2ALOX5CYP2A6PYCR1 | |
| SCHEMBL3421080 | 0.78 | AOC3 (0.36) | — | |
| SCHEMBL7609366 | 0.77 | HTR2A (0.48) | HTR2ACYP1A2ALOX5CYP2A6PYCR1 | |
| SCHEMBL26128508 | 0.77 | TRPA1 (0.48) | HTR2A | |
| SCHEMBL7982428 | 0.77 | TRPA1 (0.48) | HTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2414349-A1 | 3-Ý1,4¨OXAZEPANE-4-PYRIMIDONE DERIVATIVES | Mitsubishi Tanabe Pharma Corporation (JP) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010114179-A1 | 3-[1,4]OXAZEPANE-4-PYRIMIDONE DERIVATIVES | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2010-10-07 | — | — | WO | disclosed |