Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 5/20 | 0.39 |
| ▸ | TNKS | O95271 | 5/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 5/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.32 |
| ▸ | PLAT | P00750 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CTSC | P53634 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | NMT1 | P30419 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1717425 | 0.99 | SLC6A4 (0.41) | SLC6A4PARP1TNKSTNKS2KCNH2 | |
| SCHEMBL1719934 | 0.90 | PARP1 (0.41) | PARP1TNKSTNKS2JAK2NMT1 | |
| SCHEMBL1720253 | 0.82 | PARP1 (0.53) | PARP1TNKSTNKS2KCNH2JAK2 | |
| Hydrochloric Acid SCHEMBL1720668 | 0.81 | PARP1 (0.53) | PARP1TNKSTNKS2KCNH2JAK2 | |
| SCHEMBL1720066 | 0.78 | PARP1 (0.39) | PARP1TNKSTNKS2PLK1 | |
| SCHEMBL1719923 | 0.78 | PARP1 (0.42) | PARP1TNKSTNKS2KCNH2PLK1 | |
| Hydrochloric Acid SCHEMBL4069890 | 0.77 | PARP1 (0.41) | PARP1TNKSTNKS2KCNH2PLK1 | |
| SCHEMBL1720207 | 0.76 | PARP1 (0.43) | PARP1TNKS | |
| SCHEMBL1720211 | 0.76 | PARP1 (0.43) | PARP1TNKS | |
| SCHEMBL1719790 | 0.76 | PARP1 (0.43) | PARP1TNKS |
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-1566380-B1 | ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF | MITSUBISHI TANABE PHARMA CORP (JP) | 2012-01-11 | — | — | EP | claimed |
| US-7501412-B2 | Isoquinoline compounds and medicinal use thereof | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-03-10 | — | — | US | disclosed |
| US-7501412-B2 | Isoquinoline compounds and medicinal use thereof | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-03-10 | — | — | US | disclosed |