Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ESRRA | P11474 | 1/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7606877 | 0.85 | ADRB3 (0.44) | ADRB3TRPV1ARNR3C1PGR | |
| SCHEMBL7608285 | 0.84 | ADRB3 (0.40) | ADRB3CYP19A1ARNPC1HPGD | |
| SCHEMBL7609423 | 0.84 | ADRB3 (0.40) | ADRB3CYP19A1ARNPC1HPGD | |
| SCHEMBL7605292 | 0.83 | ACP1 (0.42) | ADRB3TRPV1CYP19A1NR3C1PDE4A | |
| SCHEMBL7604970 | 0.82 | NR3C1 (0.43) | ADRB3CYP19A1ARSMN1; SMN2NR3C1 | |
| SCHEMBL7610067 | 0.80 | AR (0.38) | ADRB3CYP19A1ARNR3C1BRD4 | |
| SCHEMBL7611191 | 0.77 | ALDH1A1 (0.44) | NPC1RAB9ASMN1; SMN2BRD4 | |
| SCHEMBL7605972 | 0.77 | ALDH1A1 (0.44) | NPC1HPGDRAB9ASMN1; SMN2ALOX5 | |
| SCHEMBL7614703 | 0.76 | SMN1; SMN2 (0.41) | CYP19A1ARNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7606168 | 0.74 | PTPN2 (0.41) | NPC1RAB9ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1230210-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001036375-A1 | AMINOALCOHOL DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-05-25 | — | — | WO | disclosed |