Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | PYGL | P06737 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8035580 | 0.79 | APP (0.51) | NPSR1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL8035171 | 0.79 | PYGL (0.45) | MEN1KMT2ATRPV1PYGLLMNA | |
| SCHEMBL8025608 | 0.77 | CA12 (0.47) | NPSR1TRPV1PYGLLMNAMAPT | |
| SCHEMBL8025601 | 0.76 | TRPV1 (0.48) | TRPV1PYGLMAPTALDH1A1 | |
| SCHEMBL8025556 | 0.74 | NPSR1 (0.42) | NPSR1CYP1A2MEN1KMT2ACYP2D6 | |
| SCHEMBL8035585 | 0.73 | HSP90AA1 (0.41) | NPSR1CYP1A2CYP3A4SMN1; SMN2APP | |
| SCHEMBL8039179 | 0.73 | PYGL (0.46) | MEN1KMT2ASMN1; SMN2PYGLNPC1 | |
| SCHEMBL8039185 | 0.73 | PYGL (0.49) | MEN1KMT2APYGLNPC1MAPT | |
| SCHEMBL8039096 | 0.72 | PYGL (0.42) | MEN1KMT2ATRPV1PYGLLMNA | |
| SCHEMBL8023948 | 0.72 | PYGL (0.46) | MEN1KMT2APYGLNPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |