Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25590736 | 0.86 | — | — | |
| SCHEMBL16115112 | 0.86 | — | — | |
| SCHEMBL239640 | 0.85 | — | — | |
| Fluoride SCHEMBL9620604 | 0.82 | KDM4E (0.46) | KCNH2HTTKDM4EALDH1A1CYP1A2 | |
| SCHEMBL465770 | 0.82 | — | — | |
| SCHEMBL454473 | 0.82 | — | — | |
| SCHEMBL22790769 | 0.79 | KDM4E (0.48) | KCNH2HTTKDM4EALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL15848302 | 0.79 | — | — | |
| SCHEMBL22316957 | 0.79 | KDM4E (0.48) | KCNH2HTTKDM4EALDH1A1CYP1A2 | |
| SCHEMBL22416728 | 0.79 | KDM4E (0.48) | KCNH2HTTKDM4EALDH1A1CYP1A2 |
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-2881394-B1 | CONDENSED RING HETEROCYCLIC COMPOUND | KYOWA HAKKO KIRIN CO LTD (JP) | 2018-03-21 | — | — | EP | disclosed |