Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | INSR | P06213 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL11287558 | 0.90 | TSHR (0.56) | TOP1RAB9AGAATSHRALDH1A1 | |
| Toluene SCHEMBL11286246 | 0.86 | TSHR (0.49) | TOP1RAB9AGAATSHRALDH1A1 | |
| Ethylbenzene SCHEMBL11288989 | 0.85 | RAB9A (0.48) | TOP1RAB9AGAATSHRALDH1A1 | |
| Anisole SCHEMBL11287389 | 0.84 | TSHR (0.47) | TOP1RAB9AGAATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11289629 | 0.81 | TOP1 (0.44) | TOP1RAB9AGAATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11289624 | 0.81 | TOP1 (0.43) | TOP1RAB9AGAATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11290083 | 0.80 | RAB9A (0.45) | TOP1RAB9AGAATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11284678 | 0.79 | ADRB2 (0.44) | TOP1RAB9AGAATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL11284028 | 0.79 | TSHR (0.41) | TOP1RAB9AGAATSHRALDH1A1 | |
| SCHEMBL11290594 | 0.78 | ALDH1A1 (0.48) | RAB9AGAATSHRALDH1A1KDM4E |
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 |