Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25324787 | 0.88 | LMNA (0.36) | HTR2BLMNAHPGDCA12CA1 | |
| SCHEMBL25933060 | 0.80 | MGLL (0.44) | HTR2BKCNH2HRH3 | |
| SCHEMBL30700024 | 0.78 | CA12 (0.39) | LMNAHPGDCA12CA1CA2 | |
| SCHEMBL30699986 | 0.76 | ALDH1A1 (0.46) | LMNAHPGDCA12CA1CA2 | |
| SCHEMBL30700424 | 0.76 | ALDH1A1 (0.46) | LMNAHPGDCA12CA1CA2 | |
| SCHEMBL31308067 | 0.76 | ALDH1A1 (0.46) | LMNAHPGDCA12CA1CA2 | |
| SCHEMBL25919891 | 0.75 | HTR2B (0.41) | HTR2BKCNH2HRH3NPC1TP53 | |
| SCHEMBL25919043 | 0.75 | MGLL (0.42) | HTR2BSMN1; SMN2USP30 | |
| SCHEMBL25325378 | 0.74 | CA1 (0.37) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25251951 | 0.74 | LMNA (0.53) | LMNAHPGDCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023144160-A1 | NEW HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-08-03 | — | — | WO | disclosed |