Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11084724 | 0.88 | ALDH1A1 (0.45) | ALDH1A1GAACYP1A2AURKAMAPT | |
| SCHEMBL11084270 | 0.88 | MEN1 (0.37) | ALDH1A1KDRMAPTMAPK1RAB9A | |
| SCHEMBL11080774 | 0.85 | NPC1 (0.42) | ALDH1A1GAAMAPTRAB9AMEN1 | |
| SCHEMBL11084914 | 0.85 | KDR (0.46) | ALDH1A1GAAKDRMAPTTSHR | |
| SCHEMBL11083402 | 0.85 | CSNK2A1 (0.42) | ALDH1A1GAAKDRAURKAAURKB | |
| SCHEMBL11092605 | 0.85 | L3MBTL1 (0.43) | GAAKDRCYP1A2PIM1AURKB | |
| SCHEMBL11085398 | 0.84 | MAPT (0.41) | ALDH1A1GAAKDRAURKAPIM1 | |
| SCHEMBL27301289 | 0.79 | PDE4A (0.53) | ALDH1A1MAPTADORA2AADORA2B | |
| SCHEMBL11087340 | 0.78 | SMN1; SMN2 (0.40) | ALDH1A1GAAMAPTMAPK1RAB9A | |
| SCHEMBL27297878 | 0.77 | CSNK2A1 (0.47) | CSNK2A1MEN1KMT2ACSF1R |
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 |
|---|---|---|---|---|---|---|---|
| EP-0126970-A2 | Anxiolytic and anti-depressant thienopyridine derivatives | BEECHAM GROUP PLC (GB) | 1984-12-05 | — | — | EP | claimed |
| EP-0126970-A2 | Anxiolytic and anti-depressant thienopyridine derivatives | BEECHAM GROUP PLC (GB) | 1984-12-05 | — | — | EP | disclosed |