Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA7 | P43166 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29853727 | 0.82 | CYP1A2 (0.40) | CA12CA1CA7CA9CA14 | |
| SCHEMBL1134725 | 0.71 | CA1 (0.56) | CA12CA1CA7CA9CA14 | |
| SCHEMBL346791 | 0.71 | CA1 (0.56) | CA12CA1CA7CA9CA14 | |
| SCHEMBL7199002 | 0.69 | MAOB (0.36) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL7199549 | 0.69 | ALDH1A1 (0.33) | CA12CA1CA7CA9CA14 | |
| SCHEMBL1451503 | 0.66 | CA1 (0.65) | CA12CA1CA7CA9CA14 | |
| SCHEMBL29153309 | 0.65 | CYP1A2 (0.56) | CA12CA1CA7CA9CA14 | |
| SCHEMBL29447161 | 0.65 | CYP1A2 (0.79) | CA12CA1CA7CA9CA14 | |
| SCHEMBL443070 | 0.65 | CYP1A2 (0.79) | CA12CA1CA7CA9CA14 | |
| SCHEMBL5229799 | 0.64 | CA12 (0.36) | CA12CA1CA7CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4284781-A1 | UROLITHIN DERIVATIVES AND METHODS OF USE THEREOF | Vandria SA (CH) | 2023-12-06 | — | — | EP | disclosed |