Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.47 |
| ▸ | CNR2 | P34972 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.43 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.42 |
| ▸ | PPIA | P62937 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8025483 | 0.96 | MEN1 (0.46) | CNR1CNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL8038995 | 0.93 | ALDH1A1 (0.52) | CNR1CNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL8041228 | 0.92 | SGMS2 (0.53) | CNR1CNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL8035613 | 0.82 | S1PR1 (0.54) | ALDH1A1MEN1KMT2ASGMS2PPIA | |
| SCHEMBL8037213 | 0.82 | MEN1 (0.51) | CNR1CNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL8025544 | 0.82 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8039098 | 0.81 | HPGD (0.48) | ALDH1A1MEN1KMT2AGAANPC1 | |
| SCHEMBL8035618 | 0.81 | APP (0.44) | MEN1KMT2ANPC1RAB9APKM | |
| SCHEMBL8025540 | 0.81 | SMN1; SMN2 (0.48) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL8039269 | 0.80 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ASGMS2NPC1 |
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 |