Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7784793 | 0.94 | KDM4E (0.44) | MAOAMAOBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL7777931 | 0.92 | MAOA (0.38) | MAOAMAOBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL7785839 | 0.90 | MAOA (0.36) | MAOAMAOBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL7783639 | 0.90 | VCAM1 (0.39) | MAOAMAOBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL8532395 | 0.77 | KDM4E (0.38) | KDM4ECYP1A2CYP2C19HPGDCYP3A4 | |
| Hydrochloric Acid SCHEMBL28752946 | 0.76 | KDM4E (0.37) | KDM4ECYP1A2CYP2C19HPGDCYP3A4 | |
| SCHEMBL7782866 | 0.76 | NPSR1 (0.35) | MAOAMAOBKDM4EHPGDMEN1 | |
| SCHEMBL7782871 | 0.74 | ALDH1A1 (0.38) | KDM4EHPGDCYP3A4MEN1KMT2A | |
| SCHEMBL7784740 | 0.73 | PTGDR2 (0.36) | MAOAMAOBKDM4ECYP2C19HPGD | |
| SCHEMBL7782990 | 0.71 | AKR1B1 (0.32) | MAOAMAOBKDM4EHPGDMEN1 |
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 |