Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | MGLL | Q99685 | 2/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23402822 | 0.93 | ALDH1A1 (0.42) | ALDH1A1CTRCTDP1L3MBTL1DAO | |
| SCHEMBL23402421 | 0.89 | ALDH1A1 (0.53) | ALDH1A1DAOPDE4AADORA2APDE4B | |
| SCHEMBL9837528 | 0.88 | ALDH1A1 (0.41) | ALDH1A1CTRCTDP1HCAR2PTGS1 | |
| SCHEMBL23402550 | 0.87 | ALDH1A1 (0.37) | ALDH1A1CTRCTDP1L3MBTL1DAO | |
| SCHEMBL23402899 | 0.86 | ALDH1A1 (0.42) | ALDH1A1TDP1L3MBTL1PDE4AADORA2A | |
| SCHEMBL23402060 | 0.85 | ALDH1A1 (0.56) | ALDH1A1PDE4AADORA2APDE4BPDE4C | |
| SCHEMBL23401168 | 0.81 | HPD (0.36) | ALDH1A1CTRCTDP1L3MBTL1DAO | |
| SCHEMBL23402237 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TDP1L3MBTL1PDE4AADORA2A | |
| SCHEMBL23402801 | 0.81 | CTRC (0.35) | ALDH1A1CTRCTDP1L3MBTL1DAO | |
| SCHEMBL23398383 | 0.77 | ALDH1A1 (0.49) | ALDH1A1HTT |
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-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |