Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8182657 | 0.75 | MEN1 (0.46) | CYP19A1CHRNB4CHRNA3ALDH1A1MEN1 | |
| SCHEMBL6931992 | 0.75 | CYP19A1 (0.40) | CYP19A1CHRNB4CHRNA3ALDH1A1CYP1A2 | |
| SCHEMBL9156355 | 0.75 | HIF1A (0.46) | CHRNB4CHRNA3ALDH1A1MEN1KMT2A | |
| SCHEMBL6938882 | 0.75 | CYP3A4 (0.44) | CHRNB4CHRNA3ALDH1A1MEN1KMT2A | |
| SCHEMBL27342629 | 0.72 | ALDH1A1 (0.41) | CHRNB4CHRNA3ALDH1A1MEN1KMT2A | |
| SCHEMBL6347611 | 0.70 | CYP19A1 (0.41) | CYP19A1CHRNB4CHRNA3ALDH1A1MEN1 | |
| SCHEMBL6936648 | 0.69 | CYP19A1 (0.40) | CYP19A1ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL2062385 | 0.67 | INSR (0.41) | ALDH1A1MEN1KMT2AMAPTLMNA | |
| SCHEMBL6560790 | 0.67 | SIRT2 (0.44) | CHRNB4CHRNA3ALDH1A1MEN1KMT2A | |
| SCHEMBL20704108 | 0.67 | PNMT (0.47) | CHRNB4CHRNA3ALDH1A1MEN1KMT2A |
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-0915087-B1 | Sulfonamide substituted fused five-membered ring compounds, their use as medicaments as well as pharmaceutical compositions containing them | AVENTIS PHARMA GMBH (DE) | 2003-04-02 | — | — | EP | disclosed |
| US-6015822-A | ANTIULCER, ANTIDIARRHEA, AND ANTIARRHYTHMIA AGENTS; CARDIOVASCULAR AND GASTROINTESTINAL DISORDERS | HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) | 2000-01-18 | — | — | US | disclosed |
| EP-0915087-A2 | Sulfonamide substituted fused five-membered ring compounds, their use as medicaments as well as pharmaceutical compositions containing them | Hoechst Marion Roussel Deutschland GmbH (DE) | 1999-05-12 | — | — | EP | disclosed |