Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ENPP3 | O14638 | 6/20 | 0.39 |
| ▸ | ENPP1 | P22413 | 6/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL27731903 | 0.90 | GAA (0.42) | ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2 | |
| SCHEMBL27711256 | 0.88 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2 | |
| SCHEMBL27711220 | 0.85 | GAA (0.42) | ALDH1A1SMN1; SMN2ENPP3ENPP1ELANE | |
| SCHEMBL27731819 | 0.84 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2 | |
| SCHEMBL27711241 | 0.84 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2 | |
| SCHEMBL27711246 | 0.81 | SMN1; SMN2 (0.44) | ALDH1A1SMN1; SMN2GAATDP1L3MBTL1 | |
| SCHEMBL27731887 | 0.80 | MAOB (0.49) | ALDH1A1SMN1; SMN2GAAMAPTMAOB | |
| SCHEMBL27731737 | 0.79 | CYP2C9 (0.43) | ALDH1A1SMN1; SMN2ENPP1ENPP2ELANE | |
| SCHEMBL27711267 | 0.77 | KMT2A (0.46) | ALDH1A1ENPP3ENPP1ENPP2ELANE | |
| SCHEMBL27731888 | 0.77 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2ENPP3ENPP1ENPP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101228142-A | Intermediate compounds for the synthesis of pharmaceutical preparations, and process for their preparation | MITSUBISHI TANABE PHARMA CORP (JP) | 2008-07-23 | — | — | CN | claimed |
| CN-102120741-A | Production method of an optically active compound | MITSUBISHI TANABE PHARMA CORP | 2011-07-13 | — | — | CN | disclosed |
| CN-102050820-A | Preparation method of compound with optical activity | MITSUBISHI TANABE PHARMA CORP | 2011-05-11 | — | — | CN | disclosed |
| CN-101228142-A | Intermediate compounds for the synthesis of pharmaceutical preparations, and process for their preparation | MITSUBISHI TANABE PHARMA CORP (JP) | 2008-07-23 | — | — | CN | disclosed |