Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24016834 | 0.88 | PIK3CD (0.35) | ALDH1A1PIK3CDCA12CA1CA2 | |
| SCHEMBL825846 | 0.74 | PIK3CD (0.39) | ALDH1A1PIK3CDCA12CA1CA2 | |
| SCHEMBL5649196 | 0.72 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL132624 | 0.72 | — | — | |
| SCHEMBL10544547 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL3269649 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL19601453 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL17169736 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL46516 | 0.71 | — | — | |
| SCHEMBL134247 | 0.68 | ADRB2 (0.38) | ALDH1A1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5643869-A | Pipecolic acid-containing peptolides, their preparation and pharmaceutical compositions containing them | SANDOZ LTD. (CH) | 1997-07-01 | — | — | US | disclosed |
| EP-0360760-B1 | Pipecolic acid containing cyclopeptolides, their preparation and pharmaceutical compositions containing them | SANDOZ AG (CH) | 1995-02-15 | — | — | EP | disclosed |
| EP-0360760-A2 | Pipecolic acid containing cyclopeptolides, their preparation and pharmaceutical compositions containing them | SANDOZ AG (CH) | 1990-03-28 | — | — | EP | disclosed |