Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | OTC | P00480 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4069482 | 0.87 | CYP2D6 (0.44) | CYP2D6CYP2C19TSHRGAASMN1; SMN2 | |
| SCHEMBL13810591 | 0.83 | KDM4E (0.54) | TSHRKMT2AMEN1GAAKDM4E | |
| SCHEMBL20836565 | 0.83 | CYP2D6 (0.52) | CYP2D6CYP2C19KMT2AMEN1GAA | |
| SCHEMBL23901022 | 0.83 | CYP2D6 (0.41) | CYP2D6CYP2C19TSHRKMT2AMEN1 | |
| SCHEMBL13810616 | 0.83 | KDM4E (0.54) | TSHRKMT2AMEN1GAAKDM4E | |
| SCHEMBL6720432 | 0.80 | CYP2D6 (0.52) | CYP2D6CYP2C19KMT2AMEN1GAA | |
| SCHEMBL2846868 | 0.78 | ALDH1A1 (0.48) | CYP2D6CYP2C19KMT2AMEN1GAA | |
| SCHEMBL3664544 | 0.78 | MEN1 (0.40) | CYP2D6CYP2C19TSHRKMT2AMEN1 | |
| SCHEMBL3772713 | 0.77 | THRB (0.39) | CYP2D6CYP2C19KMT2AMEN1GAA | |
| SCHEMBL11667778 | 0.77 | BLM (0.50) | CYP2D6CYP2C19KMT2AMEN1GAA |
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-2053038-B1 | AMINO ALCOHOL DERIVATIVE AND IMMUNOSUPPRESSIVE AGENT HAVING SAME AS AN ACTIVE INGREDIENT | KYORIN SEIYAKU KK (JP) | 2016-10-05 | — | — | EP | disclosed |
| EP-2053038-A1 | AMINOALCOHOL DERIVATIVE AND IMMUNOSUPPRESSANT CONTAINING THE SAME AS AN ACTIVE INGREDIENT | Kyorin Pharmaceutical Co., Ltd. (JP) | 2009-04-29 | — | — | EP | disclosed |