Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | CCR2 | P41597 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | CASR | P41180 | 3/20 | 0.41 |
| ▸ | MTTP | P55157 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4429519 | 1.00 | KDM4E (0.43) | KDM4EHCRTR1HCRTR2ALOX5EPHX2 | |
| SCHEMBL4435541 | 0.94 | EPHX2 (0.44) | HCRTR1HCRTR2ALOX5EPHX2CCR2 | |
| SCHEMBL4433016 | 0.94 | EPHX2 (0.44) | HCRTR1HCRTR2ALOX5EPHX2CCR2 | |
| SCHEMBL4430301 | 0.94 | EPHX2 (0.44) | HCRTR1HCRTR2ALOX5EPHX2CCR2 | |
| SCHEMBL4433201 | 0.94 | KMT2A (0.43) | KDM4EHCRTR1HCRTR2ALOX5EPHX2 | |
| SCHEMBL4429248 | 0.94 | KMT2A (0.43) | KDM4EHCRTR1HCRTR2ALOX5EPHX2 | |
| SCHEMBL4433516 | 0.94 | KMT2A (0.43) | KDM4EHCRTR1HCRTR2ALOX5EPHX2 | |
| SCHEMBL4434528 | 0.94 | KMT2A (0.43) | KDM4EHCRTR1HCRTR2ALOX5EPHX2 | |
| SCHEMBL4440167 | 0.93 | KDM4E (0.49) | KDM4ECCR2ALDH1A1TDP1CTDSP1 | |
| SCHEMBL4432938 | 0.93 | KDM4E (0.49) | KDM4ECCR2ALDH1A1TDP1CTDSP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2114867-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2009-11-11 | — | — | EP | claimed |
| WO-2008107335-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-09-12 | — | — | WO | claimed |
| EP-2114867-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008107335-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-09-12 | — | — | WO | disclosed |