Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.68 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7707974 | 0.87 | HCRTR2 (0.53) | HCRTR1HCRTR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7708626 | 0.84 | HCRTR1 (0.71) | HCRTR1HCRTR2ALDH1A1KMT2ATSHR | |
| SCHEMBL7704867 | 0.81 | HCRTR2 (1.00) | HCRTR1HCRTR2ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL7709100 | 0.81 | SMN1; SMN2 (0.51) | HCRTR1HCRTR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7704817 | 0.80 | SMN1; SMN2 (0.55) | HCRTR1HCRTR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2592911 | 0.78 | HCRTR2 (0.54) | HCRTR1HCRTR2CYP2C19L3MBTL1GAA | |
| SCHEMBL29427445 | 0.78 | GAA (0.55) | CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL13791090 | 0.76 | GAA (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL2594555 | 0.76 | HCRTR1 (0.67) | HCRTR1HCRTR2L3MBTL1ALDH1A1KMT2A | |
| SCHEMBL15631894 | 0.76 | ALDH1A1 (0.76) | CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011138265-A2 | INDOLE AND INDAZOLE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | disclosed |