Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9312893 | 0.89 | PTPN1 (0.39) | PTPN1PPARGPPARAALOX5KIF11 | |
| SCHEMBL7387979 | 0.84 | CYP1A2 (0.43) | PTPN1KIF11CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL9313695 | 0.76 | ACP3 (0.40) | KIF11MRGPRX4KDM4ESMN1; SMN2 | |
| SCHEMBL7387975 | 0.71 | CYP1A2 (0.41) | PTPN1KIF11CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL7301505 | 0.69 | PLAU (0.47) | PPARGPPARAALOX5MEN1POLB | |
| SCHEMBL16825144 | 0.68 | RAB9A (0.47) | ALOX5MRGPRX4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7301887 | 0.68 | PLAU (0.49) | CYP1A2 | |
| SCHEMBL10867877 | 0.67 | PTPN1 (0.45) | PTPN1PPARGPPARAKIF11CYP3A4 | |
| SCHEMBL9312880 | 0.64 | CYP1A2 (0.41) | PPARGPPARAALOX5KMT2ANPC1 | |
| SCHEMBL9313704 | 0.64 | ACP3 (0.39) | KIF11MEN1KMT2AMRGPRX4NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5330978-A | Cardiovascular disorders, hypotensive agents, vasodilation | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-07-19 | — | — | US | disclosed |