Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 8/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 5/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.32 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 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 | |
|---|---|---|---|---|
| SCHEMBL16613162 | 0.87 | MTOR (0.46) | PIK3CAMTOR | |
| SCHEMBL16610955 | 0.80 | PIK3CA (0.49) | PIK3CAPIK3CGPIK3R1PIK3CDPIK3CB | |
| SCHEMBL19217039 | 0.77 | ACACB (0.37) | PIK3CAPIK3CGPIK3R1PIK3CDPIK3CB | |
| SCHEMBL16613115 | 0.75 | MTOR (0.48) | PIK3CAMTOR | |
| SCHEMBL16731005 | 0.75 | MTOR (0.41) | PIK3CAPIK3CBMTOR | |
| SCHEMBL16613177 | 0.75 | MTOR (0.41) | PIK3CAPIK3CBMTOR | |
| SCHEMBL16727865 | 0.71 | MTOR (0.47) | PIK3CAPIK3R1PIK3CDMTOR | |
| SCHEMBL16727861 | 0.70 | MTOR (0.51) | PIK3CAPIK3R1ALDH1A1MTOR | |
| SCHEMBL19217037 | 0.70 | MAP3K12 (0.31) | PIK3CAPIK3CGMTORMAPK14CSNK1G1 | |
| SCHEMBL19217040 | 0.69 | ACACB (0.36) | PIK3CAPIK3CGMTORMAPTMAPK14 |
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-9724352-B2 | Pyrrolo[2,1-F[1,2,4]triazine compounds, preparation methods and applications thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2017-08-08 | — | — | US | disclosed |