Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | AHR | P35869 | 4/20 | 0.47 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8802154 | 0.85 | KDM4E (0.53) | KDM4EGAAGLAMTNR1AMTNR1B | |
| SCHEMBL8801343 | 0.78 | KDM4E (0.47) | KDM4EAHRIMPDH2MAPTALDH1A1 | |
| SCHEMBL4323256 | 0.76 | GSK3B (0.51) | AHRIMPDH2MEN1KMT2A | |
| SCHEMBL6592979 | 0.74 | AHR (0.66) | KDM4EAHRIMPDH2MTNR1AMTNR1B | |
| SCHEMBL8801366 | 0.73 | CA2 (0.52) | KDM4EGAAGLAMTNR1AMTNR1B | |
| SCHEMBL1180269 | 0.72 | KDM4E (0.61) | KDM4EGAAGLAAHRMTNR1A | |
| SCHEMBL28239180 | 0.72 | AHR (0.52) | AHRMAPTCA2MEN1HPGD | |
| SCHEMBL11304077 | 0.70 | KDM4E (0.50) | KDM4EGAAGLAMAPTALDH1A1 | |
| SCHEMBL531085 | 0.70 | ELANE (0.61) | GAAMAPTMAPK1ALDH1A1KMT2A | |
| SCHEMBL28490003 | 0.69 | MAOA (0.51) | AHRMAPTMEN1KMT2A |
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-0804416-A1 | HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS | SANKYO COMPANY LIMITED (JP) | 1997-11-05 | — | — | EP | disclosed |