Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 2/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.38 |
| ▸ | CPA1 | P15085 | 2/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL13975597 | 1.00 | CYP2C9 (0.46) | CYP2C9ALDH1A1MMEACECPA1 | |
| SCHEMBL8433765 | 0.82 | ALDH1A1 (0.37) | CYP2C9ALDH1A1MMEACECPA1 | |
| SCHEMBL15116382 | 0.82 | GAA (0.40) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL13036378 | 0.80 | CYP2C9 (0.50) | CYP2C9ALDH1A1MEN1KMT2APSMB5 | |
| SCHEMBL12295563 | 0.80 | CYP2C9 (0.50) | CYP2C9ALDH1A1MEN1KMT2APSMB5 | |
| SCHEMBL8402243 | 0.80 | CYP2C9 (0.50) | CYP2C9ALDH1A1MEN1KMT2APSMB5 | |
| SCHEMBL22304296 | 0.78 | CYP2C9 (0.48) | CYP2C9ALDH1A1MEN1KMT2AMMP1 | |
| SCHEMBL6729268 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL8145207 | 0.78 | TRPV1 (0.42) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL8134506 | 0.78 | TRPV1 (0.42) | ALDH1A1MMEACECPA1ACE2 |
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-2023154282-A1 | COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS | THERAS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |