Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 10/20 | 0.48 |
| ▸ | FEN1 | P39748 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | LOX | P28300 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7139532 | 0.75 | HTR6 (0.57) | HTR6CA1CA2CA9AKR1B1 | |
| SCHEMBL27508534 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL27508533 | 0.73 | SMPD2 (0.39) | — | |
| SCHEMBL3249669 | 0.70 | HTR6 (0.73) | HTR6FEN1CA1CA2CA9 | |
| SCHEMBL547461 | 0.70 | CA1 (0.68) | HTR6CA1CA2CA9AKR1B1 | |
| SCHEMBL7135317 | 0.70 | HTR6 (0.53) | HTR6CA1CA2CA9HTR2A | |
| SCHEMBL7143914 | 0.69 | HTR6 (0.56) | HTR6CA1CA2CA9AKR1B1 | |
| SCHEMBL5153341 | 0.69 | HTR6 (0.57) | HTR6CA1CA2CA9AKR1B1 | |
| SCHEMBL18669851 | 0.69 | CA2 (0.63) | HTR6CA1CA2CA9 | |
| SCHEMBL9587035 | 0.68 | HTR6 (0.70) | HTR6FEN1CA1CA2CA9 |
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-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 |