Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 11/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19987770 | 0.77 | TP53 (0.33) | SMN1; SMN2ALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL18256030 | 0.73 | HSP90AA1 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL13430884 | 0.73 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL28545457 | 0.72 | EPHX2 (0.39) | SMN1; SMN2ALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL29241087 | 0.71 | NOTUM (0.40) | SMN1; SMN2ALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL10271203 | 0.70 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL1106843 | 0.69 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL1090646 | 0.69 | NOTUM (0.44) | SMN1; SMN2ALDH1A1NPC1RAB9AEPHX2 | |
| SCHEMBL440363 | 0.69 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL15009179 | 0.69 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-107709323-B | Hydroxyl purine compound and application thereof | 广东众生睿创生物科技有限公司 | 2020-11-20 | — | — | CN | disclosed |