Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.51 |
| ▸ | HTR1A | P08908 | 2/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 SCHEMBL11239741 | 0.99 | DRD2 (0.51) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL11225985 | 0.95 | DRD2 (0.52) | DRD2DRD4DRD3ADRB1ADRB2 | |
| Maleic Acid SCHEMBL11219568 | 0.88 | DRD2 (0.48) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL10902167 | 0.86 | ADRB1 (0.55) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL6919618 | 0.84 | ADRB1 (0.53) | DRD2DRD4DRD3ADRB1ADRB2 | |
| Hydrochloric Acid SCHEMBL6921590 | 0.83 | ADRB1 (0.53) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL9387265 | 0.83 | DRD2 (0.50) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL9386881 | 0.82 | ADRB1 (0.55) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL11225064 | 0.82 | DRD2 (0.54) | DRD2DRD4DRD3ADRB1ADRB2 | |
| SCHEMBL9388535 | 0.81 | DRD2 (0.51) | DRD2DRD4DRD3ADRB1ADRB2 |
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-4329468-A | ADRENERGIC BLOCKING AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1982-05-11 | — | — | US | disclosed |
| US-4309432-A | TOPICAL ADMINISTRATION | OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) | 1982-01-05 | — | — | US | disclosed |
| US-4256890-A | ADRENERGIC BLOCKING AGENTS | OTSUKAPHARMACEUTICAL CO., LTD. (JP) | 1981-03-17 | — | — | US | disclosed |