Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 9/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 9/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16404086 | 0.92 | SCD (0.42) | TRPV1GRM5HCRTR1HCRTR2HSP90AA1 | |
| SCHEMBL16403958 | 0.87 | HCRTR1 (0.48) | GRM5HCRTR1HCRTR2ROCK2SCD5 | |
| SCHEMBL16404125 | 0.87 | SCD (0.47) | TRPV1ROCK2ALDH1A1MAPTGAA | |
| SCHEMBL16403960 | 0.86 | SCD (0.42) | TRPV1HCRTR1HCRTR2ROCK2SCD5 | |
| SCHEMBL16403957 | 0.83 | HSD17B10 (0.52) | HCRTR1HCRTR2ROCK2SCD5NPC1 | |
| SCHEMBL16403937 | 0.76 | NPC1 (0.47) | HCRTR1HCRTR2ROCK2SCD5NPC1 | |
| SCHEMBL16403930 | 0.76 | NPC1 (0.49) | ROCK2SCD5NPC1ALDH1A1RAB9A | |
| SCHEMBL16403918 | 0.71 | NPC1 (0.47) | ROCK2NPC1ALDH1A1PKMRAB9A | |
| SCHEMBL16403992 | 0.71 | RAB9A (0.60) | NPC1ALDH1A1PKMRAB9AGAA | |
| SCHEMBL16403916 | 0.71 | ALDH1A1 (0.48) | NPC1ALDH1A1PKMRAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-8937065-B2 | Compositions and methods for modulating a kinase | CLEVEXEL PHARMA (FR) | 2015-01-20 | — | — | US | disclosed |