Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 3/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.30 |
| ▸ | TACR1 | P25103 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21581673 | 0.84 | SCN9A (0.37) | SCN9AITGB1ITGA4CTSSCTSK | |
| SCHEMBL31089695 | 0.83 | SCN9A (0.47) | SCN9ACTSSCTSKTSHR | |
| SCHEMBL21581609 | 0.83 | L3MBTL1 (0.40) | SCN9ACTSKKLK5HSD17B10ABCB1 | |
| SCHEMBL21581617 | 0.79 | SCN9A (0.39) | SCN9ACTSSCTSKKLK5 | |
| SCHEMBL21581681 | 0.77 | NPC1 (0.40) | SCN9ABRD4LCK | |
| SCHEMBL21580624 | 0.72 | TSHR (0.42) | SCN9AITGB1ITGA4TSHRGRM5 | |
| SCHEMBL21581607 | 0.71 | SCN9A (0.50) | SCN9ACTSSCTSKABCB1CACNA1B | |
| SCHEMBL21581631 | 0.69 | NPC1 (0.46) | TSHRHSD17B10GRM5 | |
| SCHEMBL31089812 | 0.67 | SCN9A (0.48) | SCN9ACTSSCTSKGRM5ABCB1 | |
| SCHEMBL31089903 | 0.67 | SCN9A (0.48) | SCN9ACTSSCTSKTSHRHSD17B10 |
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-2019222816-A1 | SUBSTITUTED-PYRIDINYL COMPOUNDS AND USES THEREOF | BIONOMICS LIMITED (AU) | 2019-11-28 | — | — | WO | disclosed |