Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | MRGPRX1 | Q96LB2 | 3/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.34 |
| ▸ | ACP1 | P24666 | 1/20 | 0.34 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.34 |
| ▸ | PTPN13 | Q12923 | 1/20 | 0.34 |
| ▸ | SSU72 | Q9NP77 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL7610055 | 0.84 | ADRB3 (0.40) | ARALDH1A1NR3C1ACLYADRB3 | |
| SCHEMBL7605292 | 0.83 | ACP1 (0.42) | ALDH1A1NR3C1ACLYADRB3ACP1 | |
| SCHEMBL7610741 | 0.82 | ADRB3 (0.33) | ACLYADRB3BRD4ACP1PTPN12 | |
| SCHEMBL7604970 | 0.82 | NR3C1 (0.43) | ARALDH1A1NR3C1ADRB3MEN1 | |
| SCHEMBL7609423 | 0.81 | ADRB3 (0.40) | ARALDH1A1NR3C1ADRB3MAPK1 | |
| SCHEMBL7608285 | 0.81 | ADRB3 (0.40) | ARALDH1A1NR3C1ADRB3MAPK1 | |
| SCHEMBL7614703 | 0.81 | SMN1; SMN2 (0.41) | ARALDH1A1NR3C1ACP1PTPN12 | |
| SCHEMBL7606900 | 0.80 | ADRB3 (0.38) | ARNR3C1ADRB3BRD4CYP19A1 | |
| SCHEMBL7611191 | 0.79 | ALDH1A1 (0.44) | ALDH1A1BRD4MEN1MAPTKMT2A | |
| SCHEMBL7605972 | 0.79 | ALDH1A1 (0.44) | ALDH1A1MEN1MAPTKMT2A |
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 |