Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 6/20 | 0.54 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2591733 | 0.82 | HCRTR2 (0.55) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL2585096 | 0.76 | HCRTR2 (0.74) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL2594821 | 0.76 | HCRTR2 (0.50) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL7710724 | 0.74 | HCRTR2 (0.70) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL2589640 | 0.72 | HCRTR2 (0.55) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL7707423 | 0.70 | HCRTR2 (1.00) | HCRTR2HCRTR1HSD17B10ALDH1A1KDM4E | |
| SCHEMBL2594270 | 0.70 | HCRTR2 (0.75) | HCRTR2HCRTR1ALDH1A1HPGDMEN1 | |
| SCHEMBL2584748 | 0.68 | HCRTR2 (0.63) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT | |
| SCHEMBL7710901 | 0.66 | HCRTR2 (1.00) | HCRTR2HCRTR1ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL2588741 | 0.65 | HCRTR2 (0.71) | HCRTR2HCRTR1HSD17B10ALDH1A1HTT |
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-2011138266-A1 | INDOLIZINE AND IMIDAZOPYRIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | EVOTEC AG (DE) | 2011-11-10 | — | — | WO | disclosed |