Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15316166 | 0.82 | PDE10A (0.44) | SMN1; SMN2CYP3A4ALDH1A1KDM4EKMT2A | |
| SCHEMBL13259633 | 0.74 | SRC (0.35) | SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL17384384 | 0.74 | GAA (0.53) | SMN1; SMN2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL9752724 | 0.72 | CYP3A4 (0.48) | CYP3A4ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL26797236 | 0.72 | CYP3A4 (0.48) | CYP3A4ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL10607894 | 0.72 | CYP3A4 (0.48) | CYP3A4ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL9532473 | 0.70 | CYP3A4 (0.47) | CYP3A4ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL5838924 | 0.70 | CYP3A4 (0.47) | SMN1; SMN2CYP3A4ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL28502221 | 0.70 | NPSR1 (0.36) | SMN1; SMN2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL2282238 | 0.69 | SRC (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015199065-A1 | PYRIDINE COMPOUND AND USE OF SAME | 日本曹達株式会社 | 2015-12-30 | — | — | WO | disclosed |