Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL15921594 | 0.85 | NPC1 (0.50) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL29887018 | 0.82 | NPC1 (0.42) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL28833525 | 0.82 | NPC1 (0.42) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL4774742 | 0.80 | ALDH1A1 (0.47) | GAAMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL2370519 | 0.77 | MAPK1 (0.54) | NPC1RAB9AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL8715509 | 0.76 | ALDH1A1 (0.37) | RAB9AMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL16925411 | 0.75 | MAPT (0.48) | NPC1RAB9AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL8702633 | 0.75 | MAPT (0.54) | NPC1RAB9AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL30423350 | 0.75 | L3MBTL1 (0.58) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL2703926 | 0.75 | L3MBTL1 (0.58) | NPC1RAB9AGAAMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5716971-A | FOR TREATMENT OF ANGINA PECTORIS AND HYPERTENSION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-10 | — | — | US | disclosed |
| EP-0623597-B1 | Pyridine derivatives, with potassium channel opening activity | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-10-22 | — | — | EP | disclosed |
| EP-0623597-A1 | Pyridine derivatives, with potassium channel opening activity | Takeda Chemical Industries, Ltd. (JP) | 1994-11-09 | — | — | EP | disclosed |