Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | TACR1 | P25103 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.34 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL1377878 | 0.82 | KCNA5 (0.45) | MAOAMAOB | |
| SCHEMBL3098119 | 0.72 | TACR1 (0.45) | ABCG2TACR1L3MBTL1MAOAKMT2A | |
| SCHEMBL1375552 | 0.68 | KMT2A (0.49) | CYP1B1TACR1TDP1L3MBTL1KMT2A | |
| SCHEMBL3094005 | 0.64 | KCNA5 (0.63) | TACR1SMN1; SMN2 | |
| SCHEMBL9021233 | 0.64 | TDP1 (0.59) | CYP1B1TDP1L3MBTL1MAOBKMT2A | |
| SCHEMBL30002666 | 0.62 | CYP1A2 (0.46) | KCNA3TDP1L3MBTL1 | |
| SCHEMBL8764977 | 0.62 | CYSLTR2 (0.53) | S1PR5L3MBTL1MAOAPDE4APDE4B | |
| SCHEMBL9804792 | 0.62 | CYSLTR2 (0.50) | S1PR5CYSLTR2CYSLTR1 | |
| SCHEMBL10522502 | 0.62 | MEN1 (0.43) | KCNA3KMT2ALMNA | |
| SCHEMBL3625058 | 0.61 | TACR1 (0.46) | TACR1L3MBTL1MAOAKMT2ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1667982-A4 | ISOQUINOLINONE POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2008-08-13 | — | — | EP | disclosed |
| EP-1667982-A2 | ISOQUINOLINONE POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005030791-A2 | ISOQUINOLINONE POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2005-04-07 | — | — | WO | disclosed |