Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.55 |
| ▸ | MAPT | P10636 | 7/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | PRKDC | P78527 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ERN1 | O75460 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3847699 | 0.86 | ALDH1A1 (0.67) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL5338041 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL19331554 | 0.80 | ALDH1A1 (0.77) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL20783154 | 0.79 | ALDH1A1 (0.61) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL29125349 | 0.77 | ALDH1A1 (0.63) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL28704679 | 0.77 | ALDH1A1 (0.55) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL8071562 | 0.77 | ALDH1A1 (0.59) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL2723326 | 0.77 | ALDH1A1 (0.83) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL25380949 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL8946170 | 0.76 | ALDH1A1 (0.61) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 |
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 |