Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 5/20 | 0.43 |
| ▸ | DGKA | P23743 | 1/20 | 0.42 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.41 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.41 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.41 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.41 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.41 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.41 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7775809 | 0.94 | ADRB2 (0.56) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL5145221 | 0.94 | ADRB2 (0.56) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL7778381 | 0.94 | ADRB2 (0.56) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL6264326 | 0.88 | ADRB2 (0.51) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| Oleic Acid SCHEMBL6258010 | 0.84 | ADRB2 (0.62) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| Oleic Acid SCHEMBL6258016 | 0.84 | ADRB2 (0.62) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL11279271 | 0.82 | ALDH1A1 (0.47) | ADRB2HIF1AELANEDGKA | |
| Hydrochloric Acid SCHEMBL11279245 | 0.81 | ADRB2 (0.47) | ADRB2HIF1AELANE | |
| Hydrochloric Acid SCHEMBL11279255 | 0.81 | ADRB2 (0.47) | ADRB2HIF1AELANE | |
| Albuterol SCHEMBL6264324 | 0.80 | ADRB2 (0.65) | ADRB2CYP1A2CYP2D6TSHRNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113171359-B | Chuangbuterol transdermal patch and preparation method thereof | 沈阳药科大学 | 2022-11-01 | — | — | CN | disclosed |
| CN-113171359-A | Chuangbuterol transdermal patch and preparation method thereof | 沈阳药科大学 | 2021-07-27 | — | — | CN | disclosed |
| EP-1588698-A2 | A process for the production and screening of materials for use in pharmaceutical aerosol formulations | Thompson, James Anthony (GB) | 2005-10-26 | — | — | EP | disclosed |