Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 4/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 3/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11283584 | 0.88 | ADRB2 (0.37) | PDK1ALOX15ADRB2ADRA2ADRD2 | |
| SCHEMBL11279275 | 0.87 | ALOX15 (0.49) | PDK1ALOX15ADRB2ADRA2ADRD2 | |
| Hydrochloric Acid SCHEMBL11277586 | 0.86 | ALOX15 (0.48) | PDK1ALOX15ADRB2ADRA2ADRD2 | |
| Hydrochloric Acid SCHEMBL11276281 | 0.82 | ALOX15 (0.49) | ALOX15ADRB2TSHRALDH1A1KDM4E | |
| SCHEMBL11285046 | 0.81 | PTGS1 (0.39) | ALOX15ADRB2ADRA2ADRD2ADRA2C | |
| SCHEMBL11420372 | 0.81 | PDE4D (0.35) | PDK1ALOX15ADRB2ADRA2ADRD2 | |
| SCHEMBL11290594 | 0.79 | ALDH1A1 (0.48) | ADRB2TSHRALDH1A1KDM4EGAA | |
| SCHEMBL11288059 | 0.79 | ALOX15 (0.45) | ALOX15ADRB2ALDH1A1LMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL11278977 | 0.79 | ALDH1A1 (0.37) | ALOX15ADRB2TSHRALDH1A1KDM4E | |
| Benzene SCHEMBL11287558 | 0.78 | TSHR (0.56) | TSHRALDH1A1KDM4EGAARAB9A |
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 |