Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 17/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 12/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8311002 | 0.86 | HTT (0.34) | GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL8307727 | 0.85 | ALDH1A1 (0.32) | HCRTR2ALDH1A1 | |
| SCHEMBL8307229 | 0.84 | TSHR (0.32) | ALDH1A1 | |
| SCHEMBL8524545 | 0.83 | KMT2A (0.33) | HCRTR2ALDH1A1 | |
| SCHEMBL8525154 | 0.81 | HCRTR2 (0.44) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 | |
| SCHEMBL8524560 | 0.81 | HCRTR2 (0.42) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 | |
| SCHEMBL8525657 | 0.81 | HCRTR2 (0.42) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 | |
| SCHEMBL8524553 | 0.78 | HCRTR2 (0.40) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 | |
| SCHEMBL8525146 | 0.78 | HCRTR2 (0.40) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 | |
| SCHEMBL8525775 | 0.77 | HCRTR2 (0.43) | HCRTR2HCRTR1GABRG2GABRB3GABRA5 |
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-1999003856-A1 | 4-BENZOYL-ISOXAZOLE- AND -PYRAZOLE DERIVATIVES AND 2-CYANO 1,3-DIONE DERIVATIVES AS HERBICIDES | RHONE-POULENC AGRICULTURE LIMITED (GB) | 1999-01-28 | — | — | WO | disclosed |