Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 6/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20123635 | 0.93 | HSD17B3 (0.46) | HSD17B3TRPA1SLC6A2HTR2AHTR2C | |
| SCHEMBL20014977 | 0.88 | HSD17B3 (0.50) | HSD17B3TRPA1SLC6A2HTR2AHTR2C | |
| SCHEMBL3772410 | 0.81 | HSD17B3 (0.43) | HSD17B3SLC6A2HTR2AHTR2CSLC6A4 | |
| SCHEMBL20014548 | 0.79 | HPGD (0.45) | HSD17B3HTR2AHTR2CL3MBTL1CA1 | |
| SCHEMBL20123554 | 0.79 | HSD17B3 (0.43) | HSD17B3TDP1CA1CA2CA4 | |
| SCHEMBL18350153 | 0.79 | TRPA1 (0.52) | HSD17B3TRPA1SLC6A2HTR2AHTR2C | |
| SCHEMBL30439952 | 0.77 | ALDH1A1 (0.46) | HSD17B3TRPA1SLC6A2HTR2AHTR2C | |
| SCHEMBL27705121 | 0.77 | ALDH1A1 (0.46) | HSD17B3TRPA1SLC6A2HTR2AHTR2C | |
| SCHEMBL20014459 | 0.76 | HSD17B3 (0.46) | HSD17B3SLC6A2HTR2AHTR2CSLC6A4 | |
| SCHEMBL20123720 | 0.74 | NOTUM (0.37) | HSD17B3TRPA1SLC6A2HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-2620436-B1 | SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG | SHIONOGI & CO (JP) | 2018-05-09 | — | — | EP | disclosed |
| EP-2444400-B1 | SUBSTITUTED POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE | SHIONOGI & CO (JP) | 2018-03-28 | — | — | EP | disclosed |