Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.45 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CTSV | O60911 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8025472 | 0.89 | SGMS2 (0.42) | TRPM8SGMS2NPC1PKMRAB9A | |
| SCHEMBL8041224 | 0.88 | SMPD1 (0.44) | TRPM8NPC1PKMRAB9AALDH1A1 | |
| SCHEMBL8035618 | 0.84 | APP (0.44) | TRPM8NPC1PKMRAB9AMEN1 | |
| SCHEMBL8025476 | 0.83 | SMPD1 (0.47) | NPC1RAB9AMEN1KMT2ASMPD1 | |
| SCHEMBL8041228 | 0.82 | SGMS2 (0.53) | SGMS2NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL8038995 | 0.81 | ALDH1A1 (0.52) | SGMS2NPC1PKMRAB9AALDH1A1 | |
| SCHEMBL8039098 | 0.81 | HPGD (0.48) | TRPM8NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL8025478 | 0.81 | APP (0.51) | TRPM8NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8041684 | 0.80 | SMPD1 (0.44) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL8025483 | 0.79 | MEN1 (0.46) | SGMS2NPC1PKMRAB9AALDH1A1 |
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 |