Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.60 |
| ▸ | HPGDS | O60760 | 1/20 | 0.47 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.47 |
| ▸ | MAP4K1 | Q92918 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | IL2 | P60568 | 3/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.42 |
| ▸ | GAK | O14976 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.40 |
| ▸ | RBP4 | P02753 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27863678 | 0.81 | HPGDS (0.58) | HPGDSNPY5RMAP4K1MEN1CYP1A2 | |
| SCHEMBL532280 | 0.75 | PIK3CA (1.00) | PIK3CAMEN1CYP1A2CYP2D6MAPT | |
| SCHEMBL532281 | 0.73 | PIK3CA (0.72) | PIK3CAMAP4K1MEN1CYP1A2CYP2D6 | |
| SCHEMBL15975825 | 0.69 | PIK3CA (0.89) | PIK3CAMEN1CYP1A2CYP2D6MAPT | |
| SCHEMBL16332765 | 0.68 | KCNH2 (0.64) | MAP4K1MEN1CYP1A2CYP2D6MAPT | |
| SCHEMBL532219 | 0.67 | PIK3CA (0.82) | PIK3CAMEN1KMT2A | |
| SCHEMBL27846714 | 0.66 | HPGDS (0.62) | HPGDSNPY5RGAKSMPD3SCN2A | |
| SCHEMBL532220 | 0.66 | PIK3CA (0.59) | PIK3CAMAP4K1MEN1CYP1A2KMT2A | |
| SCHEMBL2842992 | 0.65 | HPGDS (1.00) | HPGDSNPY5RSMPD3SCN2A | |
| SCHEMBL28976260 | 0.65 | SMN1; SMN2 (0.47) | PIK3CAMEN1CYP1A2CYP2D6MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102388055-A | Imidazo [2, 1-b] [ 1, 3, 4 ] thiadiazole derivatives | CT NAC INVESTIGACIONES ONCOLOGICAS CNIO | 2012-03-21 | — | — | CN | disclosed |