Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL734156 | 0.78 | OPRM1 (0.57) | OPRM1OPRL1OPRK1ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL9897862 | 0.76 | OPRM1 (0.56) | OPRM1OPRL1OPRK1ALDH1A1L3MBTL1 | |
| SCHEMBL16677934 | 0.74 | OPRM1 (0.37) | OPRM1OPRL1OPRK1ALDH1A1HDAC6 | |
| SCHEMBL19104839 | 0.74 | OPRM1 (0.41) | OPRM1OPRL1OPRK1ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL19094252 | 0.73 | OPRM1 (0.40) | OPRM1OPRL1OPRK1ALDH1A1L3MBTL1 | |
| SCHEMBL19343585 | 0.70 | PDE2A (0.36) | HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL18778704 | 0.69 | POLB (0.41) | OPRM1OPRL1OPRK1ALDH1A1L3MBTL1 | |
| SCHEMBL10038868 | 0.68 | OPRM1 (0.57) | OPRM1OPRL1OPRK1ALDH1A1OGFRL1 | |
| SCHEMBL24861878 | 0.67 | LIG1 (0.33) | HDAC6 | |
| SCHEMBL24424539 | 0.67 | — | — |
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-2015061684-A1 | TREATMENT OF POLYCYSTIC DISEASES WITH AN HDAC6 INHIBITOR | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2015-04-30 | — | — | WO | disclosed |