Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 13/20 | 0.49 |
| ▸ | MTOR | P42345 | 6/20 | 0.49 |
| ▸ | PIK3R1 | P27986 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | RICTOR | Q6R327 | 1/20 | 0.45 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.45 |
| ▸ | MAPKAP1 | Q9BPZ7 | 1/20 | 0.45 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.44 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1935491 | 0.83 | KDM4E (0.46) | CYP1A2CYP2D6MAPTKDM4EGAA | |
| SCHEMBL18072393 | 0.80 | PIK3CA (0.54) | PIK3CAMTORPIK3R1KDM4EGAA | |
| SCHEMBL14541937 | 0.80 | KDM4E (0.69) | PIK3CAMTORPIK3R1MAPTKDM4E | |
| SCHEMBL7712459 | 0.80 | ALDH1A1 (0.63) | PIK3CAMTORPIK3R1KDM4EGAA | |
| SCHEMBL3721187 | 0.78 | PIK3CD (0.56) | PIK3CAMTORPIK3R1MAPTGAA | |
| SCHEMBL7714561 | 0.78 | KDM4E (0.56) | PIK3CAMTORPIK3R1KDM4EGAA | |
| SCHEMBL7282145 | 0.78 | CNR2 (0.56) | PIK3CADHFR | |
| SCHEMBL17059203 | 0.78 | ALDH1A1 (0.46) | MAPTKDM4E | |
| SCHEMBL13650825 | 0.77 | MAPT (0.54) | PIK3CAMTORPIK3R1CYP1A2CYP2D6 | |
| SCHEMBL25598894 | 0.76 | IKBKB (0.56) | PIK3CAMTORPIK3R1KDM4EGAA |
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-3782986-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2021-02-24 | — | — | EP | disclosed |