Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | FFAR2 | O15552 | 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 | |
|---|---|---|---|---|
| SCHEMBL18738751 | 0.83 | PTPN2 (0.47) | TAAR1HTR2BDAOFFAR2 | |
| SCHEMBL8099771 | 0.82 | TAAR1 (0.68) | TAAR1HDAC1HDAC8HTR2BHRH3 | |
| SCHEMBL18164547 | 0.81 | TAAR1 (0.62) | TAAR1HTR2BSIGMAR1DAO | |
| SCHEMBL31500446 | 0.80 | TAAR1 (0.61) | TAAR1HRH3 | |
| SCHEMBL3016081 | 0.80 | TAAR1 (0.61) | TAAR1HRH3 | |
| SCHEMBL2301117 | 0.80 | TAAR1 (0.57) | TAAR1HDAC1HDAC8TSHRMAOB | |
| SCHEMBL20428023 | 0.79 | TAAR1 (0.48) | TAAR1HDAC1HDAC8HTR2BMAOB | |
| SCHEMBL8092500 | 0.78 | TAAR1 (0.68) | TAAR1HTR2BHRH3DAOFDPS | |
| SCHEMBL19651374 | 0.77 | MAOB (0.58) | TAAR1HDAC1HDAC8TP53MAOB | |
| SCHEMBL9799158 | 0.77 | TAAR1 (0.63) | TAAR1HRH3MAOB |
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 |