Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 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 | |
|---|---|---|---|---|
| SCHEMBL28509946 | 0.85 | CA1 (0.42) | ALDH1A1GAAMAPTNR1H4RARB | |
| SCHEMBL31635558 | 0.83 | CYP4F2 (0.47) | ALDH1A1GAAMAPTNR1H4RARB | |
| SCHEMBL2343149 | 0.82 | ALDH1A1 (0.55) | ALDH1A1TRPA1NR1H4PLK1AGTR1 | |
| SCHEMBL9214669 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TRPA1GAAMAPTNR1H4 | |
| SCHEMBL11806978 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TRPA1NR1H4EGFRPLK1 | |
| SCHEMBL8875590 | 0.81 | MAPT (0.43) | ALDH1A1TRPA1GAAMAPTNR1H4 | |
| SCHEMBL23960204 | 0.81 | MKNK1 (0.44) | ALDH1A1TRPA1MAPTPLK1PKM | |
| SCHEMBL14387517 | 0.80 | KMT2A (0.46) | ALDH1A1GAAMAPTNR1H4SRD5A2 | |
| SCHEMBL5502090 | 0.79 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTPLK1PKM | |
| SCHEMBL777208 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TRPA1GAAMAPTNR1H4 |
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-4336400-A | BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS | STERLING DRUG INC. (US) | 1982-06-22 | — | — | US | disclosed |
| US-RE30241-E | BRONCHODILATION, ADRENERGIC STIMULANTS | STERLING DRUG INC. (US) | 1980-03-25 | — | — | US | disclosed |
| US-4138581-A | BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS | STERLING DRUGS INC. (US) | 1979-02-06 | — | — | US | disclosed |