Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.44 |
| ▸ | CNR1 | P21554 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7784737 | 0.94 | MAOA (0.42) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7777931 | 0.87 | MAOA (0.38) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7785839 | 0.85 | MAOA (0.36) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7783639 | 0.85 | VCAM1 (0.39) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL8532395 | 0.74 | KDM4E (0.38) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| Hydrochloric Acid SCHEMBL28752946 | 0.74 | KDM4E (0.37) | KDM4EALDH1A1CYP1A2CYP2C19CYP2C9 | |
| SCHEMBL7784902 | 0.72 | SMN1; SMN2 (0.34) | L3MBTL1TDP1NPSR1RXFP1PTGDR2 | |
| SCHEMBL7782871 | 0.72 | ALDH1A1 (0.38) | KDM4EALDH1A1CNR1HPGDCYP3A4 | |
| SCHEMBL7782866 | 0.71 | NPSR1 (0.35) | KDM4EALDH1A1HPGDL3MBTL1TDP1 | |
| SCHEMBL7778342 | 0.70 | PTGDR2 (0.33) | ALDH1A1CYP1A2CYP2C19CYP2C9CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0801058-B1 | Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents | AMERICAN CYANAMID CO (US) | 2001-10-10 | — | — | EP | disclosed |