Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.41 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.39 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SCNN1A | P37088 | 2/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1428391 | 0.94 | KCNH2 (0.56) | KCNH2MAPTPSMB5PSMB8PSMB9 | |
| SCHEMBL1134630 | 0.94 | KCNH2 (0.62) | KCNH2MAPTPSMB5PSMB8PSMB9 | |
| SCHEMBL1134515 | 0.89 | KCNH2 (0.65) | KCNH2MAPTPSMB5PSMB8PSMB9 | |
| SCHEMBL1134587 | 0.85 | SYK (0.53) | KCNH2MAPTL3MBTL1PAX8TDP1 | |
| SCHEMBL1134585 | 0.84 | MAPT (0.56) | KCNH2MAPTL3MBTL1PAX8TDP1 | |
| SCHEMBL11980209 | 0.83 | KCNH2 (0.62) | KCNH2SCNN1ALTA4H | |
| SCHEMBL2075136 | 0.83 | KCNH2 (0.61) | KCNH2SCNN1ALTA4H | |
| Hydrochloric Acid SCHEMBL1134542 | 0.82 | KCNH2 (0.60) | KCNH2SCNN1ALTA4H | |
| SCHEMBL11959314 | 0.81 | KCNH2 (0.64) | KCNH2SCNN1ALTA4H | |
| Iodide SCHEMBL1428394 | 0.81 | KCNH2 (0.63) | KCNH2SCNN1ALTA4H |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2300010-A2 | ORGANIC COMPOUNDS | Novartis AG (CH) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009150137-A2 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2009-12-17 | — | — | WO | disclosed |