Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL454473 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL15848302 | 0.81 | — | — | |
| SCHEMBL19171960 | 0.79 | KDM4E (0.38) | ALDH1A1TSHRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL465770 | 0.78 | — | — | |
| SCHEMBL26455030 | 0.77 | KCNH2 (0.36) | KCNH2ALDH1A1TSHRKDM4ECYP1A2 | |
| SCHEMBL22416728 | 0.76 | KDM4E (0.48) | KCNH2ALDH1A1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL22790769 | 0.76 | KDM4E (0.48) | KCNH2ALDH1A1KDM4ECYP1A2CYP2D6 | |
| SCHEMBL22316957 | 0.76 | KDM4E (0.48) | KCNH2ALDH1A1KDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL1915912 | 0.76 | — | — | |
| SCHEMBL24728 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0866734-B1 | METHOD AND COMPOSITION USEFUL FOR TREATING METAL SURFACES | CHEMAT TECHNOLOGY INC (US) | 2002-03-06 | — | — | EP | claimed |