Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4371563 | 0.83 | ALDH1A1 (0.46) | ALDH1A1GAAHTT | |
| SCHEMBL30062543 | 0.83 | ALDH1A1 (0.46) | ALDH1A1GAAHTT | |
| SCHEMBL6371294 | 0.81 | ALOX5AP (0.39) | ALDH1A1 | |
| SCHEMBL9256577 | 0.80 | BACE1 (0.32) | — | |
| SCHEMBL1747710 | 0.77 | TSHR (0.44) | TSHRALDH1A1GAAHTT | |
| SCHEMBL29504068 | 0.77 | TSHR (0.44) | TSHRALDH1A1GAAHTT | |
| SCHEMBL9264505 | 0.77 | — | — | |
| SCHEMBL28605251 | 0.76 | TSHR (0.43) | TSHRALDH1A1GAAHTT | |
| SCHEMBL10749522 | 0.76 | TSHR (0.33) | TSHR | |
| SCHEMBL8778836 | 0.74 | CHRNB2 (0.40) | ALDH1A1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5475112-A | Reducing a substituted trichloromethylpyridine derivative in presence of a proton donor and solvent | ISHIHARA SANGYO KAISHA LTD. (JP) | 1995-12-12 | — | — | US | disclosed |
| EP-0512436-A1 | Method for producing substituted pyridine derivatives | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1992-11-11 | — | — | EP | disclosed |