Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8710246 | 0.85 | XDH (0.40) | XDHALDH1A1NPC1RAB9AEGFR | |
| SCHEMBL8024858 | 0.83 | ALDH1A1 (0.39) | ALDH1A1NPC1HPGDEGFRCYP1A2 | |
| SCHEMBL8020675 | 0.79 | TDP1 (0.42) | ALDH1A1NPC1RAB9AHPGDCYP1A2 | |
| SCHEMBL8709829 | 0.76 | XDH (0.40) | XDHNPC1RAB9AEGFRCYP1A2 | |
| SCHEMBL8709273 | 0.76 | XDH (0.40) | XDHALDH1A1NPC1RAB9AS1PR1 | |
| SCHEMBL8709782 | 0.72 | SLC22A12 (0.40) | XDHNPC1RAB9AHPGDS1PR1 | |
| SCHEMBL8709054 | 0.72 | CYP3A4 (0.47) | ALDH1A1CYP2D6CYP2C19CYP3A4 | |
| SCHEMBL8715277 | 0.72 | CLCN2 (0.38) | ALDH1A1RAB9AAPAF1NSD2CASP3 | |
| SCHEMBL8709579 | 0.72 | KDM4E (0.38) | ALDH1A1RAB9ACYP2D6CYP2C19APAF1 | |
| SCHEMBL8710268 | 0.70 | XDH (0.43) | XDHNPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0802187-B1 | Hydroxypyridine derivatives, their production and their pharmaceutical use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2000-02-16 | — | — | EP | disclosed |
| US-5891895-A | POTASSIUM CHANNEL MODULATORS; ANGINA PECTORIS; HYPERTENSIVEAGENTS; CARDIOVASCULAR, RESPIRATORY SYSTEM, BRAIN, GASTROINTESTINAL AND UROGENITAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-04-06 | — | — | US | disclosed |
| EP-0802187-A1 | Hydroxypyridine derivatives, their production and their pharmaceutical use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-10-22 | — | — | EP | disclosed |