Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RPA1 | P27694 | 8/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | FABP3 | P05413 | 1/20 | 0.39 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7649039 | 0.86 | PPP1CA (0.51) | GAAKDM4EALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7656709 | 0.84 | NPC1 (0.48) | GAAKDM4EALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1229541 | 0.84 | ALDH1A1 (0.41) | GAAKDM4EALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7654423 | 0.84 | ALDH1A1 (0.47) | GAAKDM4EALDH1A1CYP1A2TSHR | |
| SCHEMBL1229338 | 0.83 | RPA1 (0.55) | GAAKDM4EALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7650664 | 0.81 | ADORA3 (0.44) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7651289 | 0.79 | MAPT (0.44) | GAAKDM4EALDH1A1CYP1A2HTT | |
| SCHEMBL7652937 | 0.78 | TNKS (0.47) | GAAKDM4EALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL7660378 | 0.78 | ALDH1A1 (0.53) | GAAKDM4EALDH1A1TSHRL3MBTL1 | |
| SCHEMBL7650490 | 0.78 | MAPK11 (0.40) | KDM4EALDH1A1MAPK11MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| US-6492407-B2 | NEUROPROTECTIVE ACTIVITY | BOEHRINGER IMGELHEIM PHARMA KG (DE) | 2002-12-10 | — | — | US | disclosed |