Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9129930 | 0.88 | PLAAT3 (0.38) | ALDH1A1RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL7444375 | 0.84 | TRPA1 (0.39) | MEN1KMT2ATRPA1TSHR | |
| SCHEMBL9133753 | 0.80 | TSHR (0.46) | ALDH1A1SMN1; SMN2RAB9AKEAP1MEN1 | |
| SCHEMBL9130646 | 0.78 | TRPM8 (0.46) | MEN1KMT2ATRPA1RECQL | |
| SCHEMBL9130921 | 0.75 | TSHR (0.47) | MEN1KMT2ATRPA1TSHR | |
| SCHEMBL9129927 | 0.73 | ALOX5 (0.50) | SMN1; SMN2RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL9134609 | 0.73 | LTA4H (0.41) | ALDH1A1FFAR1 | |
| SCHEMBL9131668 | 0.72 | CYP1A2 (0.45) | MEN1KMT2AL3MBTL1 | |
| SCHEMBL6547552 | 0.71 | GABRA1 (0.41) | TRPA1TSHRHSP90AA1 | |
| SCHEMBL107274 | 0.71 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2RAB9AKEAP1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5430155-A | Viricides, treatment of AIDS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-07-04 | — | — | US | disclosed |
| US-5294720-A | Viricides | THE DUPONT MERCK PHARMACEUTICAL CO. (US) | 1994-03-15 | — | — | US | disclosed |