Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.52 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.52 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 6/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13330280 | 0.85 | ALDH1A1 (0.44) | PIK3CAPIK3CDPIK3CBALDH1A1ALOX5 | |
| SCHEMBL13329922 | 0.75 | ALDH1A1 (0.43) | PIK3CAPIK3CDALDH1A1ALOX5HTT | |
| SCHEMBL8823050 | 0.74 | ALDH1A1 (0.79) | PIK3CAPIK3CDPIK3CBALDH1A1ALOX5 | |
| SCHEMBL508635 | 0.73 | PIK3CA (0.48) | PIK3CAPIK3CDPIK3CBALDH1A1HTT | |
| SCHEMBL510233 | 0.72 | PIK3CA (0.47) | PIK3CAPIK3CDPIK3CBALDH1A1SMN1; SMN2 | |
| SCHEMBL509579 | 0.72 | EIF2AK4 (0.39) | PIK3CAPIK3CDALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL8823061 | 0.71 | ALDH1A1 (0.78) | ALDH1A1ALOX5HTTSMN1; SMN2TDP1 | |
| SCHEMBL13070853 | 0.70 | ALDH1A1 (0.51) | PIK3CAPIK3CDPIK3CBALDH1A1ALOX5 | |
| SCHEMBL8823120 | 0.70 | ALDH1A1 (0.58) | PIK3CAPIK3CDPIK3CBALDH1A1ALOX5 | |
| SCHEMBL3328268 | 0.70 | PIK3CD (1.00) | PIK3CAPIK3CDPIK3CBALDH1A1ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010067123-A1 | 2- (PIPERIDIN-1-YL) -4-HETEROCYCLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS | ASTRAZENECA AB (SE) | 2010-06-17 | — | — | WO | disclosed |