Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM5A | P29375 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5599443 | 0.76 | KDM4E (0.46) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL5441988 | 0.75 | KDM4E (0.40) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL5615786 | 0.74 | KDM4E (0.41) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL5599337 | 0.71 | KDM4E (0.49) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL9379077 | 0.70 | CYP2D6 (0.46) | KDM4ECYP2D6MAPTL3MBTL1KDM5A | |
| SCHEMBL1503496 | 0.69 | KDM4E (0.63) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL10879078 | 0.69 | CYP2D6 (0.42) | CYP2D6KMT2AKCNH2 | |
| SCHEMBL5600881 | 0.69 | FFAR1 (0.53) | KDM4ECYP2D6MAPTFFAR1L3MBTL1 | |
| SCHEMBL4057807 | 0.69 | KDM4E (0.52) | KDM4ECYP2D6MAPTL3MBTL1KMT2A | |
| SCHEMBL15358494 | 0.68 | KDM4E (0.61) | KDM4ECYP2D6MAPTL3MBTL1KMT2A |
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-1755678-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005097192-A2 | ACTIVE SUBSTANCE COMBINATION OF A CARBINOL COMPOUND AND AN OPIOID | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2005-10-20 | — | — | WO | disclosed |