Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CCR2 | P41597 | 9/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL4428071 | 1.00 | KDM4E (0.48) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| Hydrochloric Acid SCHEMBL4431282 | 0.99 | KDM4E (0.47) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4434552 | 0.91 | CNR1 (0.51) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4427927 | 0.91 | CNR1 (0.51) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4431735 | 0.91 | KDM4E (0.49) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4433693 | 0.91 | KDM4E (0.49) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4432388 | 0.90 | KDM4E (0.46) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4430647 | 0.90 | KDM4E (0.46) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4441795 | 0.90 | KDM4E (0.46) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 | |
| SCHEMBL4432417 | 0.90 | KDM4E (0.46) | KDM4ECCR2ALDH1A1CTDSP1ALOX5 |
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-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 |