Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 9/20 | 0.86 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1381903 | 0.93 | KCNA5 (1.00) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL1382221 | 0.93 | KCNA5 (1.00) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL1384680 | 0.93 | KCNA5 (1.00) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL1386391 | 0.90 | KCNA5 (0.67) | KCNA5KCNH2MAPK1TSHRMAT2A | |
| SCHEMBL3123340 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL3125705 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL1381798 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL3109317 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRKDM4E | |
| SCHEMBL3125696 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRALK | |
| SCHEMBL1385545 | 0.83 | KCNA5 (0.81) | KCNA5KCNH2MAPK1TSHRALK |
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-1667979-A4 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2007-04-18 | — | — | EP | disclosed |
| EP-1667979-A2 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | Merck & Co., Inc. (US) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005030130-A2 | ISOQUINOLINE POTASSIUM CHANNEL INHIBITORS | MERCK & CO., INC. (US) | 2005-04-07 | — | — | WO | disclosed |