Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCA | P17252 | 2/20 | 0.41 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | GSR | P00390 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330699 | 1.00 | PRKCA (0.41) | PRKCAPRKCDCYP2D6CYP1A2PKM | |
| SCHEMBL20278757 | 0.84 | GABBR2 (0.41) | CYP2D6CYP1A2PKMSMN1; SMN2NPSR1 | |
| SCHEMBL14576377 | 0.83 | RIPK1 (0.34) | CYP2D6CYP1A2PKMSMN1; SMN2NPSR1 | |
| SCHEMBL5362272 | 0.83 | RIPK1 (0.34) | CYP2D6CYP1A2PKMSMN1; SMN2NPSR1 | |
| SCHEMBL14611842 | 0.83 | RIPK1 (0.34) | CYP2D6CYP1A2PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28922762 | 0.81 | PRKCA (0.40) | PRKCAPRKCDCYP2D6CYP1A2PKM | |
| SCHEMBL15300270 | 0.81 | GABBR2 (0.36) | CYP2D6CYP1A2PKMSMN1; SMN2NPSR1 | |
| SCHEMBL14878508 | 0.80 | RIPK1 (0.47) | CYP2D6RIPK1L3MBTL1AOC3 | |
| SCHEMBL1154991 | 0.80 | RIPK1 (0.47) | CYP2D6RIPK1L3MBTL1AOC3 | |
| SCHEMBL9023303 | 0.78 | RIPK1 (0.46) | TRPA1RIPK1AOC3SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3801896-A1 | RAPIDLY RELEASED BIOORTHOGONAL CAGING GROUPS | University of Utah Research Foundation (US) | 2021-04-14 | — | — | EP | disclosed |