Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 12/20 | 0.42 |
| ▸ | MAOB | P27338 | 12/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL27476972 | 0.82 | FTO (0.68) | FTOMAOAMAOBKDM4EALDH1A1 | |
| Ethoxycarbonyl Group SCHEMBL28790188 | 0.80 | SIGMAR1 (0.44) | DYRK1AFTOMAOAMAOBSIGMAR1 | |
| Chromone SCHEMBL27464281 | 0.76 | MAOB (0.64) | FTOMAOAMAOBSIGMAR1ACHE | |
| Ethoxycarbonyl Group SCHEMBL27648948 | 0.75 | CYP2A6 (0.45) | FTOMAOAMAOB | |
| Ethoxycarbonyl Group SCHEMBL28007143 | 0.72 | CHRM2 (0.41) | FTOMAOAMAOBKDM4EMEN1 | |
| Ethoxycarbonyl Group SCHEMBL27610325 | 0.72 | KDM4E (0.48) | FTOMAOAMAOBSIGMAR1KDM4E | |
| SCHEMBL7617877 | 0.72 | FTO (0.72) | DYRK1AFTOMAOAMAOBACHE | |
| SCHEMBL28532367 | 0.72 | KDM4E (0.62) | DYRK1AMAOAMAOBSIGMAR1ACHE | |
| Ethoxycarbonyl Group SCHEMBL27596280 | 0.72 | FTO (0.35) | FTOMAOAMAOBMEN1ALDH1A1 | |
| Hydroquinone SCHEMBL27658224 | 0.72 | ESR1 (0.47) | MAOBACHEKDM4EMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101977505-A | Farnesoid x receptor agonists | SMITHKLINE BEECHAM CORP | 2011-02-16 | — | — | CN | disclosed |