Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 3/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20640929 | 0.92 | MIF (0.50) | MIFHTTALDH1A1HPGDTSHR | |
| SCHEMBL24518104 | 0.84 | THRB (0.38) | HTTALDH1A1HPGDTSHRCYP2C19 | |
| SCHEMBL24518114 | 0.82 | POLB (0.41) | HTTALDH1A1HPGDTSHRMAPK10 | |
| SCHEMBL24517870 | 0.75 | PPM1B (0.36) | MIFHTTALDH1A1HPGD | |
| SCHEMBL25400795 | 0.74 | POLB (0.44) | HTTHPGDPDE4APDE4BPDE4C | |
| SCHEMBL8444142 | 0.73 | MIF (0.58) | MIFHTTALDH1A1POLBCYP1A2 | |
| SCHEMBL24517972 | 0.73 | CYP1A2 (0.36) | HTTALDH1A1HPGDTSHRMAPK10 | |
| SCHEMBL24978879 | 0.70 | — | — | |
| SCHEMBL25397623 | 0.69 | PSMB5 (0.52) | — | |
| SCHEMBL25397619 | 0.69 | PSMB5 (0.52) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1285352-A | Preparation for lignal like material | SHIONOGI & CO (JP) | 2001-02-28 | — | — | CN | disclosed |
| CN-1104622-A | Preparation of lignan analogues | SHIONOGI & CO (JP) | 1995-07-05 | — | — | CN | disclosed |