Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15918783 | 0.95 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2MAPTKDM4EHPGD | |
| SCHEMBL13508830 | 0.85 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPTKDM4EHPGD | |
| SCHEMBL16160599 | 0.78 | FAAH (0.36) | ALDH1A1PPARGPPARAPPARD | |
| SCHEMBL14415237 | 0.78 | SLC5A2 (0.35) | ALDH1A1SMN1; SMN2MAPTHTTPDE4A | |
| SCHEMBL14626184 | 0.78 | SLC5A2 (0.35) | ALDH1A1SMN1; SMN2MAPTHTTPDE4A | |
| SCHEMBL14415238 | 0.78 | SLC5A2 (0.35) | ALDH1A1SMN1; SMN2MAPTHTTPDE4A | |
| SCHEMBL14404262 | 0.75 | MEN1 (0.41) | ALDH1A1SMN1; SMN2KDM4ECYP3A4MAPK1 | |
| SCHEMBL13077184 | 0.74 | CYP3A4 (0.56) | ALDH1A1SMN1; SMN2MAPTKDM4EHPGD | |
| SCHEMBL8247946 | 0.74 | CYP3A4 (0.56) | ALDH1A1SMN1; SMN2MAPTKDM4EHPGD | |
| SCHEMBL8249233 | 0.74 | CYP3A4 (0.56) | ALDH1A1SMN1; SMN2MAPTKDM4EHPGD |
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-2014115174-A2 | NOVEL APPROACH FOR SYNTHESIS OF CATECHINS | SPHAERA PHARMA PVT. LTD. (IN) | 2014-07-31 | — | — | WO | disclosed |