Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.33 |
| ▸ | GCK | P35557 | 2/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL12947582 | 0.93 | NPC1 (0.34) | PIK3CAMTORMAPK14KDRMAP4K1 | |
| SCHEMBL13105654 | 0.92 | CNR1 (0.33) | PIK3CAMTORCNR1MAPK14MAP4K1 | |
| SCHEMBL952919 | 0.92 | PIK3C3 (0.40) | PIK3CAMTORCNR1MAPK14PIK3C3 | |
| SCHEMBL12918088 | 0.90 | PIK3CA (0.39) | PIK3CAMTORMAPK14PIK3C3MEN1 | |
| SCHEMBL12947642 | 0.90 | PIK3CA (0.40) | PIK3CAMTORMAPK14METKDR | |
| SCHEMBL12947719 | 0.90 | PIK3CA (0.37) | PIK3CAMTORCNR1MAPK14MET | |
| SCHEMBL12947632 | 0.90 | MAPK14 (0.40) | PIK3CAMTORMAPK14MEN1KMT2A | |
| SCHEMBL15935925 | 0.89 | PIK3CA (0.39) | PIK3CAMTORCNR1MAPK14MET | |
| SCHEMBL954626 | 0.89 | PIK3CA (0.42) | PIK3CAMTORMEN1KMT2ALMNA | |
| SCHEMBL12947608 | 0.89 | PIK3CA (0.38) | PIK3CAMTORCNR1MAPK14MET |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9139589-B2 | Heteroaryls and uses thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2015-09-22 | — | — | US | disclosed |
| US-8796314-B2 | Heteroaryls and uses thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2014-08-05 | — | — | US | disclosed |