Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CASR | P41180 | 2/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 7/20 | 0.44 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4433971 | 1.00 | CNR1 (0.48) | CNR1CNR2KMT2ALMNAHTT | |
| SCHEMBL4434777 | 0.89 | KMT2A (0.39) | CNR1CNR2KMT2ALMNAHTT | |
| SCHEMBL4430291 | 0.88 | P2RX7 (0.41) | ALDH1A1P2RX7EP300 | |
| SCHEMBL4434565 | 0.88 | P2RX7 (0.41) | ALDH1A1P2RX7EP300 | |
| Hydrochloric Acid SCHEMBL4432260 | 0.87 | P2RX7 (0.41) | KMT2AALDH1A1P2RX7EP300MEN1 | |
| SCHEMBL4433559 | 0.87 | P2RX7 (0.41) | KMT2AALDH1A1P2RX7EP300 | |
| SCHEMBL4438596 | 0.87 | P2RX7 (0.41) | KMT2AALDH1A1P2RX7EP300 | |
| SCHEMBL4432377 | 0.87 | P2RX7 (0.40) | KMT2AALDH1A1P2RX7EP300 | |
| SCHEMBL4431769 | 0.87 | P2RX7 (0.40) | KMT2AALDH1A1P2RX7EP300 | |
| SCHEMBL4434954 | 0.86 | CNR1 (0.54) | CNR1CNR2KMT2ALMNAHTT |
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 |