Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.43 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.43 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.43 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.43 |
| ▸ | ADH1B | P00325 | 1/20 | 0.43 |
| ▸ | ADH1C | P00326 | 1/20 | 0.43 |
| ▸ | ADH1A | P07327 | 1/20 | 0.43 |
| ▸ | ADH4 | P08319 | 1/20 | 0.43 |
| ▸ | ADH7 | P40394 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | EBP | Q15125 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Propylene Oxide SCHEMBL28348097 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| Phosphoric Acid SCHEMBL11779241 | 0.89 | S1PR1 (0.58) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| Heptane SCHEMBL11710497 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TSHREPHX1SIGMAR1EBP | |
| SCHEMBL22915556 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL23929261 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL23929276 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL23929263 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL22288098 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL22288104 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL22835051 | 0.80 | TSHR (0.93) | ALDH1A1TSHRS1PR2S1PR4S1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4310683-A | Sulfosuccinate diesters | WITCO CHEMICAL CORPORATION (US) | 1982-01-12 | — | — | US | disclosed |