Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13330018 | 0.87 | ALDH1A1 (0.42) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13329816 | 0.86 | ALDH1A1 (0.46) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13329792 | 0.74 | ALDH1A1 (0.43) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13329905 | 0.73 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2PIK3CDPIK3CAPIK3CB | |
| SCHEMBL16404868 | 0.72 | PIK3CD (0.72) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL8823061 | 0.72 | ALDH1A1 (0.78) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13329796 | 0.72 | ALDH1A1 (0.42) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13330280 | 0.71 | ALDH1A1 (0.44) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13787617 | 0.71 | PIK3CD (0.74) | ALDH1A1NPSR1SMN1; SMN2HTTTDP1 | |
| SCHEMBL13330109 | 0.70 | PIN1 (0.43) | — |
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-2010067125-A1 | 2- (PIPERIDIN-1-YL) -4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS | ASTRAZENECA AB (SE) | 2010-06-17 | — | — | WO | disclosed |