Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 8/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7138650 | 0.86 | HTR6 (0.63) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7138635 | 0.81 | HTR6 (0.62) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7137208 | 0.79 | HTR6 (0.60) | HTR6HTR2AHTR1DHTR2CTSHR | |
| SCHEMBL7137233 | 0.78 | HTR6 (0.65) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7138866 | 0.76 | HTR6 (0.53) | HTR6HTR2AHTR1DHTR2CNPC1 | |
| SCHEMBL8527822 | 0.74 | HTR6 (0.57) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7138620 | 0.74 | HTR6 (1.00) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7138609 | 0.73 | HTR6 (1.00) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7137357 | 0.70 | HTR6 (0.78) | HTR6HTR2AHTR1DHTR2CCYP3A4 | |
| SCHEMBL7138328 | 0.69 | HTR6 (0.83) | HTR6HTR2AHTR1DHTR2CCYP3A4 |
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 |