Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 6/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7611675 | 0.88 | ADRB2 (0.41) | ADRB2ADRB1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL7612142 | 0.79 | ADRB3 (0.52) | ELANEADRB2ADRB1HIF1ACYP1A2 | |
| SCHEMBL7610581 | 0.75 | ADRB2 (0.45) | ADRB2ADRB1ALDH1A1LMNAADRB3 | |
| Hydrochloric Acid SCHEMBL7608379 | 0.74 | MEN1 (0.37) | ADRB2ADRB1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL7610781 | 0.73 | ADRB2 (0.40) | ADRB2ADRB1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL7610435 | 0.72 | ADRB2 (0.52) | ADRB2ADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL7606867 | 0.69 | HIF1A (0.48) | ADRB2ADRB1HIF1ACYP1A2CYP2D6 | |
| SCHEMBL7608796 | 0.69 | ADRB3 (0.60) | ADRB2ADRB1ADRB3 | |
| SCHEMBL7608479 | 0.68 | ADRB3 (0.48) | ADRB2ADRB1ALDH1A1LMNAADRB3 | |
| SCHEMBL19335346 | 0.67 | ELANE (0.53) | ELANE |
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 |