Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | NCF1 | P14598 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2123656 | 0.91 | PIK3CA (0.41) | PIK3CAHTTTRPV1USP2CASP1 | |
| SCHEMBL2124095 | 0.88 | PIK3CA (0.52) | PIK3CAHTTTRPV1MEN1KMT2A | |
| SCHEMBL248736 | 0.85 | PIK3CA (0.54) | PIK3CAGBA1MEN1KMT2ATP53 | |
| SCHEMBL2712128 | 0.84 | HRH4 (0.48) | PIK3CASMN1; SMN2 | |
| SCHEMBL2125290 | 0.83 | PIK3CA (0.47) | PIK3CANPY5RSMN1; SMN2 | |
| SCHEMBL2711898 | 0.81 | PIK3CA (0.50) | PIK3CAKMT2ASMN1; SMN2 | |
| SCHEMBL2608578 | 0.81 | PIK3CA (0.47) | PIK3CA | |
| SCHEMBL2711142 | 0.80 | MAPT (0.47) | PIK3CAABCG2HTTMEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL2124393 | 0.79 | PIK3CA (0.42) | PIK3CA | |
| SCHEMBL2711374 | 0.78 | TRPV1 (0.40) | TRPV1MAPT |
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-2445886-B1 | 4-AMINOQUINOLINE DERIVATIVES AS PI3K INHIBITORS | AMGEN INC (US) | 2016-03-30 | — | — | EP | disclosed |