Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 3/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | RARA | P10276 | 4/20 | 0.44 |
| ▸ | RARB | P10826 | 4/20 | 0.44 |
| ▸ | RARG | P13631 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.43 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.43 |
| ▸ | TACR2 | P21452 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8846009 | 0.82 | PTPN1 (0.50) | ALDH1A1RXRARXRBRXRGRARA | |
| SCHEMBL8845987 | 0.79 | ALDH1A1 (0.42) | ALDH1A1RXRARXRBRXRGRARA | |
| SCHEMBL9269550 | 0.78 | POLB (0.55) | RXRARXRBRXRGRARARARB | |
| SCHEMBL8846081 | 0.78 | CA1 (0.45) | RXRARXRBRXRGRARARARB | |
| SCHEMBL8845972 | 0.78 | ERN1 (0.45) | RXRARXRBRXRGRARARARB | |
| SCHEMBL2459308 | 0.77 | ALDH1A1 (0.60) | ALDH1A1AOX1SMN1; SMN2TACR2PPARG | |
| SCHEMBL8675711 | 0.77 | PPARG (0.50) | ALDH1A1RXRARXRBRXRGRARA | |
| SCHEMBL14682676 | 0.77 | MAOA (0.57) | ALDH1A1AOX1SMN1; SMN2TACR2MEN1 | |
| SCHEMBL1180820 | 0.76 | MAOA (0.56) | ALDH1A1AOX1SMN1; SMN2TACR2MAPT | |
| SCHEMBL3838099 | 0.74 | RARB (0.57) | ALDH1A1RXRARXRBRXRGRARA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0664282-B1 | Biaryl phospholipase A2 inhibitors | BRISTOL MYERS SQUIBB CO (US) | 1997-10-22 | — | — | EP | disclosed |
| EP-0664282-A1 | Biaryl phospholipase A2 inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-07-26 | — | — | EP | disclosed |
| US-5391817-A | Antiinflammatory agents | BRISTOL-MYERS SQUIBB (US) | 1995-02-21 | — | — | US | disclosed |