Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 7/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3485503 | 0.77 | SLC6A4 (0.47) | SLC6A4HTR2AKCNH2EPAS1ATM | |
| SCHEMBL1643426 | 0.71 | SLC6A4 (0.44) | SLC6A4HTR2AKCNH2SCN9AATM | |
| SCHEMBL4064597 | 0.70 | HDAC3 (0.49) | SLC6A4HTR2AKCNH2L3MBTL1LMNA | |
| SCHEMBL30002156 | 0.70 | HDAC3 (0.49) | SLC6A4HTR2AKCNH2L3MBTL1LMNA | |
| SCHEMBL30879495 | 0.68 | SLC6A4 (0.46) | SLC6A4HTR2AKCNH2EPAS1SCN9A | |
| SCHEMBL15244924 | 0.68 | SCN9A (0.59) | SLC6A4HTR2AKCNH2SCN9AL3MBTL1 | |
| SCHEMBL30377054 | 0.67 | KLF10 (0.40) | MAPTCYP3A4CYP2D6NPSR1 | |
| SCHEMBL142651 | 0.67 | KLF10 (0.40) | MAPTCYP3A4CYP2D6NPSR1 | |
| SCHEMBL16959556 | 0.67 | CYP1A2 (0.55) | SLC6A4HTR2AKCNH2L3MBTL1ATM | |
| SCHEMBL192055 | 0.66 | ALDH1A1 (0.35) | — |
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-2257536-A2 | CYCLIC DIARYL ETHER AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS | Amira Pharmaceuticals, Inc. (US) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009102893-A2 | CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 receptors | AMIRA PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | WO | disclosed |