Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2529176 | 0.87 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL2529177 | 0.87 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL27557042 | 0.86 | ALDH1A1 (0.44) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL1705499 | 0.84 | ALDH1A1 (0.49) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL3158801 | 0.82 | USP2 (0.45) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL18852406 | 0.82 | PIK3CD (0.58) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL1189317 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HTTMAPTKDM4ESMN1; SMN2 | |
| SCHEMBL21564360 | 0.81 | HPGD (0.45) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL31082333 | 0.81 | HPGD (0.45) | ALDH1A1HTTMAPTNPC1MAPK1 | |
| SCHEMBL16825817 | 0.80 | USP2 (0.49) | ALDH1A1HTTMAPTNPC1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010138589-A1 | BICYCLIC PYRIMIDINE PI3K INHIBITOR COMPOUNDS SELECTIVE FOR P110 DELTA, AND METHODS OF USE | GENENTECH, INC. (US) | 2010-12-02 | — | — | WO | disclosed |
| EP-1812445-A1 | PHARMACEUTICAL COMPOUNDS | Piramed Limited (GB) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006046031-A1 | PHARMACEUTICAL COMPOUNDS | PIRAMED LIMITED (GB) | 2006-05-04 | — | — | WO | disclosed |