Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.46 |
| ▸ | CTRC | Q99895 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9046183 | 0.78 | ALDH1A1 (0.47) | ALDH1A1TAAR1LMNAPDE4APDE4B | |
| SCHEMBL9045459 | 0.77 | ALDH1A1 (0.47) | ALDH1A1LMNAHTR1AKDM4E | |
| SCHEMBL599659 | 0.74 | CYP2C19 (0.62) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL29490353 | 0.74 | CYP2C19 (0.62) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL2118499 | 0.74 | CYP1A2 (0.48) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL11328087 | 0.72 | CYP2C19 (0.60) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL4667060 | 0.72 | CYP2C19 (0.60) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| Hydrogen Sulfide SCHEMBL11348128 | 0.72 | CYP2C19 (0.60) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL659517 | 0.72 | CYP2C19 (0.60) | ADRA2AADRA2BADRA2CCTRCADRA1A | |
| SCHEMBL659516 | 0.72 | CYP2C19 (0.60) | ADRA2AADRA2BADRA2CCTRCADRA1A |
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-0510526-B1 | Use of sulfonamides as drug and new sulfonamides | HOFFMANN LA ROCHE (CH) | 1996-12-04 | — | — | EP | disclosed |
| US-5270313-A | Treatment of circulatory disorders | HOFFMANN-LA ROCHE INC. (US) | 1993-12-14 | — | — | US | disclosed |
| EP-0510526-A1 | Use of sulfonamides as drug and new sulfonamides | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1992-10-28 | — | — | EP | disclosed |