Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.33 |
| ▸ | ERN1 | O75460 | 2/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | UNG | P13051 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2558260 | 0.89 | ALDH1A3 (0.38) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2KDM4E | |
| SCHEMBL29955126 | 0.87 | ALDH1A1 (0.43) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2KDM4E | |
| SCHEMBL2554161 | 0.85 | ALDH1A1 (0.39) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2KDM4E | |
| SCHEMBL2561620 | 0.81 | ALDH1A1 (0.36) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2KDM4E | |
| SCHEMBL29953969 | 0.81 | ALDH1A3 (0.43) | ALDH1A3ALDH1A1ALDH3A1KDM4EPTGS2 | |
| SCHEMBL29952749 | 0.79 | ALDH1A1 (0.37) | ALDH1A3ALDH1A1SMN1; SMN2PLA2G7PARP10 | |
| SCHEMBL2555667 | 0.79 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2ERN1 | |
| SCHEMBL7995434 | 0.77 | ALDH1A3 (0.65) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2KDM4E | |
| SCHEMBL29956039 | 0.76 | ERN1 (0.40) | ALDH1A1KDM4EERN1 | |
| SCHEMBL29953881 | 0.76 | ALDH1A3 (0.48) | ALDH1A3ALDH1A1ALDH3A1SMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |