Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 5/20 | 0.76 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.76 |
| ▸ | AKR1C3 | P42330 | 7/20 | 0.68 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.68 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.68 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.68 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.68 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.68 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.68 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.68 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.68 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.68 |
| ▸ | FABP2 | P12104 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.68 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.68 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL8195056 | 0.87 | CYP2C19 (0.62) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL5142539 | 0.86 | APP (1.00) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL9667811 | 0.83 | AKR1C3 (0.80) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL7412229 | 0.82 | AKR1C3 (0.74) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| 4'-Hydroxyflurbiprofen SCHEMBL6450842 | 0.82 | APP (0.97) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| 4'-Hydroxyflurbiprofen SCHEMBL7040151 | 0.82 | APP (0.97) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| Flurbiprofen SCHEMBL28766226 | 0.82 | AKR1C3 (0.94) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| Tarenflurbil SCHEMBL26131 | 0.82 | AKR1C3 (1.00) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| Flurbiprofen SCHEMBL8754830 | 0.82 | AKR1C3 (1.00) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| Flurbiprofen SCHEMBL8754978 | 0.82 | AKR1C3 (1.00) | APPCYP2C19AKR1C3AKR1C2PTGS2 |
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-0979226-A1 | ISOXAZOLE DERIVATIVES | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 2000-02-16 | — | — | EP | disclosed |
| WO-1998047880-A1 | ISOXAZOLE DERIVATIVES | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1998-10-29 | — | — | WO | disclosed |