Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.32 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | CASP6 | P55212 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8709311 | 1.00 | ALDH1A1 (0.34) | ALDH1A1ARMAPTGRM4HTT | |
| SCHEMBL8712972 | 0.90 | GRM4 (0.33) | GRM4KCNA3KCNA5TLR7NR3C1 | |
| SCHEMBL8712977 | 0.90 | GRM4 (0.33) | GRM4KCNA3KCNA5TLR7NR3C1 | |
| SCHEMBL8710053 | 0.86 | MAPT (0.35) | ALDH1A1MAPTGRM4HTTKDM4E | |
| SCHEMBL8710049 | 0.86 | MAPT (0.35) | ALDH1A1MAPTGRM4HTTKDM4E | |
| SCHEMBL8713273 | 0.86 | GRM4 (0.34) | ALDH1A1GRM4TLR7KDM4E | |
| SCHEMBL8711983 | 0.86 | GSTA1 (0.41) | ALDH1A1ARMAPTGRM4TLR7 | |
| SCHEMBL8714262 | 0.86 | GRM4 (0.34) | ALDH1A1GRM4TLR7KDM4E | |
| SCHEMBL8711981 | 0.86 | GSTA1 (0.41) | ALDH1A1ARMAPTGRM4TLR7 | |
| SCHEMBL8713277 | 0.86 | GRM4 (0.34) | ALDH1A1GRM4TLR7KDM4E |
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 |