Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | PARG | Q86W56 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | STAT6 | P42226 | 1/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18256643 | 0.78 | ADORA2B (0.56) | RXFP1ADORA2BPOLBLMNASMN1; SMN2 | |
| SCHEMBL18256704 | 0.75 | TNF (0.47) | PARGALDH1A1ADORA2BTNFMAPT | |
| SCHEMBL18819575 | 0.73 | POLB (0.39) | HTTALDH1A1RXFP1ADORA2BPOLB | |
| SCHEMBL20090066 | 0.73 | PARG (0.46) | HTTPARG | |
| SCHEMBL18256641 | 0.73 | FEN1 (0.53) | PARGRXFP1 | |
| SCHEMBL18256622 | 0.72 | SMN1; SMN2 (0.49) | ALDH1A1POLBLMNASMN1; SMN2 | |
| SCHEMBL18256689 | 0.72 | PARG (0.41) | PARGALDH1A1CYP2C9CYP2C19MAPK1 | |
| SCHEMBL18256710 | 0.72 | KMT2A (0.51) | ADORA2BPOLBLMNAMAPT | |
| SCHEMBL18256623 | 0.72 | KMT2A (0.43) | ADORA2BPOLBLMNAMAPT | |
| SCHEMBL19246110 | 0.71 | POLB (0.35) | HTTALDH1A1ADORA2BPOLBCYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3205652-A1 | HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF | Medshine Discovery Inc. (CN) | 2017-08-16 | — | — | EP | disclosed |
| WO-2017071606-A1 | MEDICAL USE OF HYDROXYL PURINE COMPOUND | 南京明德新药研发股份有限公司 | 2017-05-04 | — | — | WO | disclosed |