Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | PPID | Q08752 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MGAM | O43451 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | SI | P14410 | 1/20 | 0.50 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11190772 | 0.85 | RAB9A (0.72) | ALDH1A1NPC1RAB9APPIDLMNA | |
| Ethyl Acetate SCHEMBL27878629 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TSHRNPC1RAB9ALMNA | |
| SCHEMBL10597046 | 0.81 | RAB9A (0.49) | ALDH1A1TSHRNPC1RAB9APPID | |
| Hydrochloric Acid SCHEMBL2379884 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRNPC1RAB9ALMNA | |
| SCHEMBL1557559 | 0.81 | ALDH1A1 (0.61) | ALDH1A1NPC1RAB9APPIDLMNA | |
| SCHEMBL3851346 | 0.81 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9APPIDLMNA | |
| SCHEMBL9636764 | 0.80 | TSHR (0.68) | ALDH1A1TSHRNPC1RAB9ALMNA | |
| SCHEMBL8337648 | 0.80 | ALDH1A1 (0.57) | ALDH1A1TSHRNPC1RAB9APPID | |
| Bicarbonate SCHEMBL4671806 | 0.80 | ALDH1A1 (0.81) | ALDH1A1TSHRNPC1RAB9ALMNA | |
| Bicarbonate SCHEMBL14811027 | 0.80 | ALDH1A1 (0.81) | ALDH1A1TSHRNPC1RAB9ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0025846-B1 | IMPROVED PROCESS FOR THE PREPARATION OF VINYLCYCLOPROPANE DERIVATIVES | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1984-03-07 | — | — | EP | disclosed |
| EP-0025846-A1 | Improved process for the preparation of vinylcyclopropane derivatives | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1981-04-01 | — | — | EP | disclosed |
| US-4252739-A | ALKYLATING AGENT SUCH AS 1,4-DIHALO-2-BUTENE, AN ACTIVE METHYLENE COMPOUND, A CATALYTIC ONIUM COMPOUND, AN ALKALI METAL COMPOUND AND WATER; ONE STEP | EMERY INDUSTRIES, INC. (US) | 1981-02-24 | — | — | US | disclosed |