Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 4/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ADH1B | P00325 | 1/20 | 0.35 |
| ▸ | ADH1C | P00326 | 1/20 | 0.35 |
| ▸ | ADH1A | P07327 | 1/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | ADH7 | P40394 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 2/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL4669117 | 0.81 | KDM5A (0.39) | ALOX5LMNAEPHX1HPGDKMT2A | |
| SCHEMBL27787282 | 0.79 | ALOX5 (0.32) | ALOX5 | |
| SCHEMBL7471043 | 0.78 | ALOX5 (0.50) | ALOX5HDAC1HDAC6LMNAEPHX1 | |
| SCHEMBL1843886 | 0.75 | EPHX1 (0.38) | ALOX5HDAC6LMNAEPHX1HPGD | |
| SCHEMBL2468579 | 0.73 | LMNA (0.32) | LMNA | |
| SCHEMBL8773484 | 0.72 | HDAC1 (0.61) | HDAC1HDAC6LMNAKMT2AEPHX2 | |
| SCHEMBL7760755 | 0.71 | ALOX5 (0.67) | ALOX5HDAC1HDAC6EPHX1HPGD | |
| SCHEMBL2413777 | 0.71 | ALOX5 (0.46) | ALOX5HDAC1HDAC6EPHX1HPGD | |
| SCHEMBL25487468 | 0.70 | ALOX5 (0.40) | ALOX5EPHX1ADH1BADH1CADH1A | |
| SCHEMBL29952531 | 0.69 | ADH1A (0.40) | ALOX5HDAC1HDAC6EPHX1ADH1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2001876-A2 | 8-AZABICYCLOÝ3.2.1¨OCTANE COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007103187-A2 | 8-AZABICYCLO[3.2.1]OCTANE COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2007-09-13 | — | — | WO | disclosed |