Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TNKS | O95271 | 2/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL1720349 | 0.98 | TNKS2 (0.40) | TNKS2PARP1ALDH1A1KDM4ETNKS | |
| SCHEMBL13901576 | 0.81 | PARP1 (0.45) | TNKS2PARP1TNKSLMNACYP1A2 | |
| SCHEMBL13901573 | 0.81 | PARP1 (0.40) | TNKS2PARP1TNKSPGR | |
| SCHEMBL13901581 | 0.80 | HTT (0.42) | TNKS2PARP1ALDH1A1KDM4ETNKS | |
| Iodide SCHEMBL1720204 | 0.80 | PARP1 (0.44) | TNKS2PARP1TNKSLMNACYP1A2 | |
| Iodide SCHEMBL1719674 | 0.80 | PARP1 (0.39) | TNKS2PARP1TNKSPGR | |
| Iodide SCHEMBL1720530 | 0.79 | HTT (0.41) | TNKS2PARP1ALDH1A1KDM4ETNKS | |
| SCHEMBL1719746 | 0.77 | PARP1 (0.47) | TNKS2PARP1ALDH1A1KDM4ETNKS | |
| SCHEMBL13901566 | 0.76 | CHRM2 (0.38) | TNKS2PARP1ALDH1A1KDM4ETNKS | |
| Iodide SCHEMBL1720544 | 0.75 | CHRNA7 (0.40) | TNKS2PARP1ALDH1A1KDM4ETNKS |
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-1566380-B1 | ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF | MITSUBISHI TANABE PHARMA CORP (JP) | 2012-01-11 | — | — | EP | disclosed |
| US-7501412-B2 | Isoquinoline compounds and medicinal use thereof | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-03-10 | — | — | US | disclosed |