Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7277184 | 1.00 | MAPT (0.42) | MAPTCYP3A4BRD4ALDH1A1KDM4E | |
| SCHEMBL7277292 | 1.00 | MAPT (0.42) | MAPTCYP3A4BRD4ALDH1A1KDM4E | |
| SCHEMBL7274442 | 0.86 | KDM4E (0.41) | MAPTCYP3A4ALDH1A1KDM4EMAOA | |
| SCHEMBL7269563 | 0.86 | KDM4E (0.41) | MAPTCYP3A4ALDH1A1KDM4EMAOA | |
| SCHEMBL7269567 | 0.86 | KDM4E (0.41) | MAPTCYP3A4ALDH1A1KDM4EMAOA | |
| SCHEMBL10710146 | 0.78 | CYP3A4 (0.47) | MAPTCYP3A4BRD4ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL10709161 | 0.75 | CYP3A4 (0.34) | MAPTCYP3A4BRD4ACHE | |
| SCHEMBL10711798 | 0.72 | FDPS (0.41) | MAPTCYP3A4BRD4ALDH1A1KDM4E | |
| SCHEMBL10711789 | 0.72 | FDPS (0.41) | MAPTCYP3A4BRD4ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL10714768 | 0.70 | CYP3A4 (0.35) | MAPTCYP3A4BRD4ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0352832-B1 | COMPOUNDS WITH BRONCHODILATOR ACTIVITY | AKZO N.V. (NL) | 1992-05-06 | — | — | EP | disclosed |
| US-5026724-A | Benzothiophene derivatives | AKZO N.V. (NL) | 1991-06-25 | — | — | US | disclosed |
| EP-0352832-A1 | Compounds with bronchodilator activity | AKZO N.V. (NL) | 1990-01-31 | — | — | EP | disclosed |