Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.49 |
| ▸ | METAP2 | P50579 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22288342 | 0.84 | LRRK2 (0.44) | HSD17B10CYP1A2CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL15125436 | 0.77 | GAA (0.52) | ALDH1A1HSD17B10GAADCUN1D1METAP2 | |
| SCHEMBL10801976 | 0.77 | DCUN1D1 (0.43) | ALDH1A1DCUN1D1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL16790012 | 0.76 | CYP1A2 (0.62) | ALDH1A1HSD17B10GAACYP1A2CYP3A4 | |
| SCHEMBL12127343 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL23066466 | 0.76 | ALDH1A1 (0.61) | ALDH1A1HSD17B10GAADCUN1D1CYP1A2 | |
| SCHEMBL17194909 | 0.75 | BRD4 (0.36) | ALDH1A1HSD17B10GAADCUN1D1CYP1A2 | |
| SCHEMBL2099637 | 0.75 | IDO1 (0.48) | ALDH1A1CYP1A2CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL9173243 | 0.73 | IDO1 (0.47) | ALDH1A1CYP1A2CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL174453 | 0.73 | CYP1A2 (0.54) | ALDH1A1HSD17B10CYP1A2CYP3A4CYP2D6 |
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-2011103016-A2 | COMPOSITIONS AND METHODS FOR INHIBITING EZH2 | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2011-08-25 | — | — | WO | disclosed |