Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 10/20 | 0.47 |
| ▸ | PPARG | P37231 | 5/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | FABP2 | P12104 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11750435 | 0.95 | PPARA (0.50) | PPARAPPARGCYP1A2CYP3A4MEN1 | |
| SCHEMBL11752082 | 0.91 | PPARA (0.47) | PPARAPPARGCYP1A2CYP3A4MEN1 | |
| SCHEMBL11752410 | 0.91 | PPARG (0.43) | PPARAPPARGCYP1A2MAPTCYP2C19 | |
| SCHEMBL11746557 | 0.86 | ALDH1A1 (0.42) | PPARAPPARGMEN1MAPTCYP2C19 | |
| SCHEMBL11749170 | 0.85 | PPARA (0.39) | PPARAPPARGMEN1CYP2D6MAPT | |
| SCHEMBL11751258 | 0.85 | PPARG (0.49) | PPARAPPARGCYP1A2MEN1CYP2C19 | |
| SCHEMBL11750749 | 0.81 | PPARA (0.47) | PPARAPPARGCYP1A2CYP3A4MEN1 | |
| SCHEMBL11754896 | 0.81 | MEN1 (0.38) | PPARAPPARGMEN1MAPTCYP2C19 | |
| SCHEMBL11752678 | 0.80 | PPARA (0.38) | PPARAPPARGCYP1A2MEN1CYP2D6 | |
| SCHEMBL11753169 | 0.77 | PPARG (0.40) | PPARAPPARGMEN1MAPTKMT2A |
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-4051173-A | Phenoxyalkanol derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-09-27 | — | — | US | claimed |
| US-4051173-A | Phenoxyalkanol derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-09-27 | — | — | US | disclosed |