Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G4A | P47712 | 1/20 | 0.47 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 6/20 | 0.38 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL22748701 | 0.85 | MGLL (0.40) | PLA2G4AACE2ALDH1A1CNR1 | |
| SCHEMBL22748659 | 0.85 | PLA2G4A (0.46) | PLA2G4AALDH1A1TP53TSHRLPAR1 | |
| SCHEMBL22748688 | 0.85 | PLA2G4A (0.46) | PLA2G4AALDH1A1TP53TSHRLPAR1 | |
| SCHEMBL22748660 | 0.85 | PLA2G4A (0.46) | PLA2G4AALDH1A1TP53TSHRLPAR1 | |
| SCHEMBL9150323 | 0.79 | CNR1 (0.56) | PLA2G4AALDH1A1TP53TSHRRARB | |
| SCHEMBL21413172 | 0.79 | CNR1 (0.56) | PLA2G4AALDH1A1TP53TSHRRARB | |
| SCHEMBL22291138 | 0.79 | CNR1 (0.56) | PLA2G4AALDH1A1TP53TSHRRARB | |
| SCHEMBL22748596 | 0.77 | ALDH1A1 (0.41) | PLA2G4AALDH1A1TP53TSHRRARB | |
| SCHEMBL25691915 | 0.77 | AKR1B1 (0.42) | PLA2G4ALPAR1KMT2A | |
| SCHEMBL10222961 | 0.77 | ACE2 (0.42) | ACE2ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020245291-A1 | PYRROLE DERIVATIVES AS ACC INHIBITORS | ALMIRALL, S.A. (ES) | 2020-12-10 | — | — | WO | claimed |
| WO-2020245291-A1 | PYRROLE DERIVATIVES AS ACC INHIBITORS | ALMIRALL, S.A. (ES) | 2020-12-10 | — | — | WO | disclosed |