Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1362 | 1.00 | ALDH1A1 (0.56) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Hydrogen Sulfide SCHEMBL28277423 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Fluoride SCHEMBL29094702 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL9804074 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL8934653 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Fluoride SCHEMBL29135590 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL7143035 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Potassium Ion SCHEMBL7143040 | 0.97 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL1847802 | 0.93 | CA1 (0.55) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Benzenethiol SCHEMBL27708403 | 0.87 | ALDH1A1 (0.68) | ALDH1A1HSD17B10ACHELMNACES1 |
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-0784614-A1 | THE PREPARATION OF FLUORINATED ORGANIC COMPOUNDS | British Nuclear Fuels PLC (GB) | 1997-07-23 | — | — | EP | disclosed |
| WO-1997005106-A1 | THE PREPARATION OF FLUORINATED ORGANIC COMPOUNDS | BRITISH NUCLEAR FUELS PLC (GB) | 1997-02-13 | — | — | WO | disclosed |