Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.40 |
| ▸ | HTR3B | O95264 | 2/20 | 0.40 |
| ▸ | HTR3A | P46098 | 2/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | THPO | P40225 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5916571 | 0.81 | METAP2 (0.54) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10502063 | 0.75 | METAP2 (0.39) | ALDH1A1KDM4ETDP1HTR3EHTR3B | |
| SCHEMBL10502474 | 0.74 | ALDH1A1 (0.38) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10501746 | 0.73 | METAP2 (0.43) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10501733 | 0.73 | METAP2 (0.36) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10748283 | 0.72 | METAP2 (0.36) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10748013 | 0.72 | METAP2 (0.36) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10746688 | 0.71 | KDM4E (0.35) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10501589 | 0.71 | METAP2 (0.61) | ALDH1A1KDM4ETDP1CYP3A4HTT | |
| SCHEMBL10747356 | 0.70 | AURKA (0.44) | ALDH1A1KDM4EHTR3AHSD17B10NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4711961-A | Benzisoselenazolethiones and process for the treatment of various diseases in humans | A. NATTERMANN & CIE GMBH (DE) | 1987-12-08 | — | — | US | disclosed |
| EP-0154851-A1 | Benzisoselenazolethiones,process for their preparation and pharmaceutical products containing these compounds | A. Nattermann & Cie. GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |