Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1C | Q14123 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | THPO | P40225 | 2/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7350735 | 0.83 | PDE1C (0.69) | PDE1CALDH1A1GAAADORA3HSD17B10 | |
| SCHEMBL7343547 | 0.83 | ADORA3 (0.47) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL7348023 | 0.83 | CACNA1C (0.48) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL7349519 | 0.83 | ADORA3 (0.57) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL7350412 | 0.81 | PDE1C (0.65) | PDE1CCYP2C9CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL10926541 | 0.81 | PDE1C (0.57) | PDE1CCYP2C9CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL7342397 | 0.81 | ADORA3 (0.47) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL7351367 | 0.80 | ADORA3 (0.69) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL7340139 | 0.79 | ADORA3 (0.47) | CYP2C9CYP1A2ALDH1A1CYP2D6TSHR | |
| SCHEMBL10744164 | 0.78 | ALDH1A1 (0.54) | ALDH1A1TSHRGAAADORA3KDM4E |
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-4833150-A | HYPOTENSIVES, ANTIARRHYTHMIA AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1989-05-23 | — | — | US | disclosed |
| US-4652573-A | HYPOTENSIVE AGENTS | NELSON RESEARCH & DEVELOPMENT CO. (US) | 1987-03-24 | — | — | US | disclosed |