Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTA1 | P08263 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8711981 | 1.00 | GSTA1 (0.41) | GSTA1MEN1KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8713283 | 0.99 | GSTA1 (0.40) | GSTA1MEN1KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8713280 | 0.99 | GSTA1 (0.40) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8714255 | 0.93 | MEN1 (0.38) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8714258 | 0.93 | MEN1 (0.38) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8715207 | 0.91 | MEN1 (0.36) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8715203 | 0.91 | MEN1 (0.36) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8713261 | 0.89 | KDM4E (0.42) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8709643 | 0.89 | MEN1 (0.35) | GSTA1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8709170 | 0.89 | MEN1 (0.36) | GSTA1MEN1KMT2ANPC1RAB9A |
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 |