Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 5/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 4/20 | 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 SCHEMBL11283581 | 0.88 | PDE4A (0.41) | ALOX15PDK1PDE4APDE4BPDE4C | |
| SCHEMBL11279273 | 0.85 | ALOX15 (0.51) | ALOX15PDK1PDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL11277579 | 0.84 | ALOX15 (0.50) | ALOX15PDK1PDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL11276274 | 0.82 | ALOX15 (0.53) | ALOX15PDK1PDE4APDE4BPDE4C | |
| SCHEMBL11290593 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4EGAATSHRRAB9A | |
| SCHEMBL11288055 | 0.78 | ALOX15 (0.49) | ALOX15ALDH1A1KDM4EGAATSHR | |
| Hydrochloric Acid SCHEMBL11278973 | 0.78 | ALDH1A1 (0.38) | ALOX15PDK1PDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL11282567 | 0.78 | ADRB2 (0.47) | ALDH1A1KDM4EGAATSHRRAB9A | |
| Hydrochloric Acid SCHEMBL11277598 | 0.77 | ALOX15 (0.48) | ALOX15PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL11279679 | 0.77 | PDK1 (0.38) | ALOX15PDK1ALDH1A1KDM4EGAA |
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 |