Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8764904 | 0.97 | ALDH1A1 (0.56) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL1362 | 0.97 | ALDH1A1 (0.56) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Hydrogen Sulfide SCHEMBL28277423 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Fluoride SCHEMBL29135590 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL9804074 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Fluoride SCHEMBL29094702 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Potassium Ion SCHEMBL7143040 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL8934653 | 0.95 | ALDH1A1 (0.54) | ALDH1A1HSD17B10ACHELMNACES1 | |
| SCHEMBL1847802 | 0.90 | CA1 (0.55) | ALDH1A1HSD17B10ACHELMNACES1 | |
| Benzenethiol SCHEMBL27708403 | 0.85 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0930302-B1 | Benzosulfone derivatives | HOFFMANN LA ROCHE (CH) | 2003-04-02 | — | — | EP | disclosed |
| US-5990105-A | POSSESS A SELECTIVE AFFINITY TO 5HT-6 RECEPTORS; TREATING OR PREVENTING PSYCHOSES, SCHIZOPHRENIA, MANIC DEPRESSIONS, DEPRESSIONS, NEUROLOGICAL DISORDERS, PARKINSON'S, AMYOTROPHIC LATERAL SCLEROSIS, ALZHEIMER'S AND HUNTINGTON'S DISEASE | HOFFMANN-LA ROCHE INC. (US) | 1999-11-23 | — | — | US | disclosed |
| EP-0930302-A2 | Benzosulfone derivatives | F.HOFFMANN-LA ROCHE AG (CH) | 1999-07-21 | — | — | EP | disclosed |
| CN-1038413-C | Therapeutic amides | ZENECA LTD (GB) | 1998-05-20 | — | — | CN | disclosed |
| CN-1069727-A | The acid amides that is used for the treatment of | ICI PLC (GB) | 1993-03-10 | — | — | CN | disclosed |