Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCA | P17252 | 1/20 | 0.55 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 1/20 | 0.35 |
| ▸ | FNTB | P49356 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3059138 | 0.86 | PRKCA (0.69) | PRKCAPTPN2HTR7KCNH2ALDH1A1 | |
| SCHEMBL8032698 | 0.84 | HTR7 (0.59) | PRKCAPTPN2HTR7KCNH2FNTA | |
| SCHEMBL6888816 | 0.80 | PRKCA (0.76) | PRKCAPTPN2HTR7KCNH2ALDH1A1 | |
| SCHEMBL6888447 | 0.79 | PRKCA (0.77) | PRKCAPTPN2HTR7KCNH2 | |
| SCHEMBL30153039 | 0.78 | KCNH2 (0.71) | PRKCAPTPN2HTR7KCNH2CYP2D6 | |
| SCHEMBL13016557 | 0.77 | KCNH2 (0.74) | PRKCAPTPN2HTR7KCNH2GAA | |
| SCHEMBL1769593 | 0.76 | KCNH2 (0.70) | PRKCAPTPN2HTR7KCNH2CYP2D6 | |
| SCHEMBL3777490 | 0.75 | KCNH2 (0.58) | PRKCAPTPN2HTR7KCNH2 | |
| SCHEMBL3041934 | 0.73 | PRKCA (0.73) | PRKCAPTPN2HTR7KCNH2 | |
| SCHEMBL3783069 | 0.73 | PRKCA (0.53) | PRKCAPTPN2HTR7KCNH2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009051715-A1 | QUINOLIZIDINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2009-04-23 | — | — | WO | disclosed |