Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL5700554 | 0.78 | HCAR2 (0.39) | HCAR2CYP19A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL28097110 | 0.78 | HCAR2 (0.39) | HCAR2CYP19A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL28468744 | 0.75 | ADRB2 (0.46) | HCAR2CYP19A1CHRNB2CHRNA4MKNK1 | |
| SCHEMBL16491297 | 0.75 | CYP11B2 (0.41) | HCAR2CHRNB2CHRNA4MKNK1MKNK2 | |
| SCHEMBL20775371 | 0.75 | ADRB2 (0.46) | HCAR2CYP19A1CHRNB2CHRNA4MKNK1 | |
| SCHEMBL17000186 | 0.75 | HCAR2 (0.36) | HCAR2CYP19A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL197638 | 0.74 | — | — | |
| SCHEMBL9251314 | 0.73 | HCAR2 (0.39) | HCAR2 | |
| SCHEMBL8174231 | 0.73 | HCAR2 (0.39) | HCAR2CYP19A1CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL7544931 | 0.73 | HCAR2 (0.39) | HCAR2CHRNB2CHRNA4MKNK1MKNK2 |
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 |