Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | CYP2J2 | P51589 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 2/20 | 0.45 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9786834 | 0.97 | CYP2J2 (0.46) | PAX8KCNH2CYP2J2HRH1DNMT1 | |
| SCHEMBL9786848 | 0.93 | DNMT1 (0.46) | PAX8KCNH2CYP2J2HRH1DNMT1 | |
| Oxalic Acid SCHEMBL9786851 | 0.93 | CYP2J2 (0.46) | PAX8KCNH2CYP2J2MEN1HRH1 | |
| SCHEMBL9786892 | 0.88 | CYP2J2 (0.59) | PAX8KCNH2CYP2J2MEN1HRH1 | |
| SCHEMBL9786906 | 0.86 | PAX8 (0.48) | PAX8KCNH2CYP2J2MEN1HRH1 | |
| SCHEMBL9874468 | 0.83 | CYP2J2 (0.54) | KCNH2CYP2J2MEN1DNMT1EHMT2 | |
| SCHEMBL9786973 | 0.83 | HRH1 (0.49) | PAX8KCNH2CYP2J2HRH1 | |
| SCHEMBL9872366 | 0.82 | CYP2J2 (0.51) | KCNH2CYP2J2HRH1DNMT1EHMT2 | |
| SCHEMBL9786919 | 0.82 | BCHE (0.58) | KCNH2CYP2J2MEN1HRH1 | |
| SCHEMBL9787022 | 0.82 | HRH1 (0.48) | PAX8KCNH2CYP2J2HRH1 |
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-5063235-A | 4-[(diaryl)hydromethyl]-1-piperidinealkanols and esters and carbamates thereof useful in the treatment of allergic disorders | A. H. ROBINS COMPANY, INC. (US) | 1991-11-05 | — | — | US | disclosed |