Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAPDH | P04406 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2880798 | 0.87 | ALOX5 (0.39) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL17787300 | 0.85 | ALOX5 (0.37) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL827372 | 0.80 | ALOX5 (0.35) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL8107643 | 0.80 | ALOX5 (0.39) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL439568 | 0.80 | TAS1R3 (0.36) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL26662117 | 0.80 | CES2 (0.38) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL26662132 | 0.80 | CES2 (0.38) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL22244930 | 0.79 | SLC6A2 (0.46) | KMT2ACYP2D6CYP2C9CYP2C19SLC6A2 | |
| SCHEMBL28646079 | 0.79 | SLC6A2 (0.46) | ALOX5CES2CES1KEAP1LMNA | |
| SCHEMBL28785571 | 0.79 | LMNA (0.35) | ALOX5CES2CES1KEAP1LMNA |
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-2023212548-A1 | TRICYCLIC PYRIDONES AND PYRIMIDONES | ERASCA, INC. (US) | 2023-11-02 | — | — | WO | disclosed |
| US-5417844-A | Sulfur compounds | INSTITUT FRANCAIS DU PETROLE (FR) | 1995-05-23 | — | — | US | disclosed |