Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1449854 | 0.89 | ALDH1A1 (0.40) | TSHRALDH1A1IDO1KMT2AMAPT | |
| Ammonia Solution, Strong SCHEMBL27695494 | 0.86 | ALDH1A1 (0.38) | ALDH1A1IDO1MAPTTHRBCNR1 | |
| Hydrochloric Acid SCHEMBL28664937 | 0.86 | IDO1 (0.39) | ALDH1A1IDO1MAPTTHRBCNR1 | |
| SCHEMBL14740733 | 0.86 | ALDH1A1 (0.38) | ALDH1A1IDO1MAPTTHRBCNR1 | |
| SCHEMBL310740 | 0.86 | TSHR (0.50) | TSHRALDH1A1ACHEMAPK1MEN1 | |
| Ethylene Glycol SCHEMBL27945549 | 0.83 | TSHR (0.48) | TSHRALDH1A1ACHEMAPK1MEN1 | |
| SCHEMBL28301933 | 0.83 | TSHR (0.48) | TSHRALDH1A1ACHEMAPK1MEN1 | |
| SCHEMBL15180220 | 0.83 | TSHR (0.48) | TSHRALDH1A1ACHEMAPK1MEN1 | |
| SCHEMBL27171690 | 0.81 | ALDH1A1 (0.38) | TSHRALDH1A1ACHEMEN1KMT2A | |
| SCHEMBL15180221 | 0.78 | TSHR (0.44) | TSHRALDH1A1ACHEMAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2620436-B1 | SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG | SHIONOGI & CO (JP) | 2018-05-09 | — | — | EP | disclosed |