Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11237380 | 0.99 | DRD3 (0.43) | DRD3TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL11367098 | 0.87 | HTR6 (0.44) | DRD3TSHRTP53CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL11234315 | 0.87 | HTR6 (0.40) | DRD3HTR6L3MBTL1HRH3PTPN1 | |
| Hydrochloric Acid SCHEMBL11231511 | 0.86 | HTR6 (0.43) | DRD3TSHRTP53CYP1A2CYP3A4 | |
| SCHEMBL11227272 | 0.86 | KDM4E (0.38) | DRD3TDP1HTR6ALDH1A1HRH3 | |
| SCHEMBL11362472 | 0.81 | HTR6 (0.41) | DRD3TSHRTP53CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL11250180 | 0.81 | HTR6 (0.60) | TSHRTP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9653138 | 0.79 | HRH3 (0.40) | HTR6HRH3 | |
| SCHEMBL11724685 | 0.75 | CYP1A2 (0.46) | TSHRCYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL11386590 | 0.74 | HTR6 (0.41) | TDP1HTR6ALDH1A1HRH3KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4256890-A | ADRENERGIC BLOCKING AGENTS | OTSUKAPHARMACEUTICAL CO., LTD. (JP) | 1981-03-17 | — | — | US | claimed |
| US-4329468-A | ADRENERGIC BLOCKING AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1982-05-11 | — | — | US | disclosed |
| US-4256890-A | ADRENERGIC BLOCKING AGENTS | OTSUKAPHARMACEUTICAL CO., LTD. (JP) | 1981-03-17 | — | — | US | disclosed |