Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL31062192 | 0.84 | KDM4E (0.39) | CHRM3KDM4EMTNR1AMTNR1B | |
| SCHEMBL31062558 | 0.80 | AKR1B1 (0.39) | KDM4EPTGER2 | |
| SCHEMBL7807520 | 0.79 | MTNR1A (0.41) | HSP90AB1ALDH1A1KDM4EHPGDPDGFRB | |
| SCHEMBL1115348 | 0.72 | HSP90AB1 (0.62) | HSP90AB1ALDH1A1HPGDGAAGFER | |
| SCHEMBL31062262 | 0.72 | CHRM3 (0.41) | CHRM3KDM4E | |
| SCHEMBL10268100 | 0.71 | ALDH1A1 (0.44) | HSP90AB1ALDH1A1KDM4EGLAHPGD | |
| SCHEMBL8063678 | 0.70 | MAPK8 (0.46) | HSP90AB1ALDH1A1 | |
| SCHEMBL16993027 | 0.70 | HSD17B10 (0.44) | HSP90AB1ALDH1A1KDM4EHPGDGAA | |
| SCHEMBL31062420 | 0.70 | ABCB1 (0.38) | HSP90AB1ALDH1A1KDM4EHPGDPTGER2 | |
| SCHEMBL14354674 | 0.69 | HSP90AB1 (0.56) | HSP90AB1ALDH1A1KDM4EGLAHPGD |
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-2024168004-A1 | BIARYL AMIDE-CONTAINING AGONISTS OF OREXIN RECEPTOR TYPE 2 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2024-08-15 | — | — | WO | disclosed |