Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | PDE5A | O76074 | 2/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8713015 | 0.75 | CNR2 (0.34) | PDE5APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7871653 | 0.75 | PDE5A (0.37) | ALDH1A1KMT2APDE5APDE4APDE4B | |
| Hydrochloric Acid SCHEMBL7872363 | 0.74 | PDE5A (0.36) | ALDH1A1KMT2APDE5APDE4APDE4B | |
| Hydrochloric Acid SCHEMBL7870354 | 0.71 | ALDH1A1 (0.43) | ALDH1A1LMNAPKMMAPK1 | |
| SCHEMBL7868708 | 0.70 | GPR119 (0.43) | MAPTPKM | |
| SCHEMBL7871625 | 0.68 | TDP1 (0.38) | ALDH1A1NPY5RPOLB | |
| Hydrochloric Acid SCHEMBL7872294 | 0.67 | ALDH1A1 (0.33) | ALDH1A1PDE5APDE4APDE4BPDE4C | |
| SCHEMBL7868943 | 0.67 | MEN1 (0.38) | ALDH1A1KMT2AMEN1CYP2C9NPY5R | |
| SCHEMBL7872398 | 0.67 | TDP1 (0.42) | ALDH1A1NPY5RPOLB | |
| SCHEMBL14606672 | 0.66 | ALDH1A1 (0.68) | ALDH1A1KMT2AMEN1CYP2C9GBA1 |
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-0826686-A2 | Tricyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-04 | — | — | EP | disclosed |