Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.33 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | GPR183 | P32249 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21728216 | 0.85 | DAO (0.45) | DAOSLC6A2SLC6A4SLC6A3PTGS1 | |
| SCHEMBL12802112 | 0.82 | MAPT (0.36) | SLC6A2SLC6A4SLC6A3PTGS1PTGS2 | |
| SCHEMBL3681287 | 0.82 | DAO (0.41) | DAOHDAC1 | |
| SCHEMBL1257233 | 0.81 | DAO (0.49) | DAOSLC6A2SLC6A4SLC6A3MMP13 | |
| SCHEMBL2690913 | 0.81 | SLC6A2 (0.38) | DAOSLC6A2SLC6A4SLC6A3MMP13 | |
| SCHEMBL24595109 | 0.78 | PTGS1 (0.33) | PTGS1PTGS2 | |
| SCHEMBL8163443 | 0.78 | ESR1 (0.57) | PTGS1GABRA1 | |
| SCHEMBL8349643 | 0.76 | SLC6A2 (0.50) | DAOSLC6A2SLC6A4SLC6A3MMP13 | |
| SCHEMBL23903966 | 0.76 | SLC6A2 (0.58) | DAOSLC6A2SLC6A4SLC6A3PTGS1 | |
| SCHEMBL14424432 | 0.75 | PTGS1 (0.32) | PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2013209-B1 | PYRAZOLO-TETRAHYDROPYRIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-01-19 | — | — | EP | disclosed |