Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9156355 | 0.81 | HIF1A (0.46) | TSHRKDM1AHIF1ATDP1ALDH1A1 | |
| SCHEMBL27342629 | 0.79 | ALDH1A1 (0.41) | TSHRHIF1ATDP1ALDH1A1CHRNB4 | |
| SCHEMBL2061536 | 0.79 | AKR1B1 (0.44) | CYP3A4TSHRKDM1ATDP1ALDH1A1 | |
| SCHEMBL2062655 | 0.76 | CYP1A2 (0.39) | CYP3A4TSHRKDM1ATDP1ALDH1A1 | |
| SCHEMBL9689179 | 0.75 | TLR3 (0.45) | CYP3A4TSHRKDM1AHIF1ATDP1 | |
| SCHEMBL9689181 | 0.75 | TLR3 (0.45) | CYP3A4TSHRKDM1AHIF1ATDP1 | |
| SCHEMBL6935009 | 0.75 | CYP19A1 (0.39) | CYP3A4TSHRHIF1AALDH1A1CHRNB4 | |
| SCHEMBL6931992 | 0.74 | CYP19A1 (0.40) | CYP3A4HIF1AALDH1A1CHRNB4CHRNA3 | |
| SCHEMBL20704108 | 0.73 | PNMT (0.47) | HIF1AALDH1A1CHRNB4CHRNA3MEN1 | |
| SCHEMBL7655403 | 0.73 | HIF1A (0.47) | TSHRHIF1ATDP1ALDH1A1CHRNB4 |
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 |