Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 7/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | RARG | P13631 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.33 |
| ▸ | CYBB | P04839 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL15485538 | 0.83 | NCF1 (0.39) | NCF1RARARARBRARGPDE3B | |
| SCHEMBL12903736 | 0.83 | NOS3 (0.41) | NOS3NOS1NOS2RXRAGRIN1 | |
| SCHEMBL23640025 | 0.81 | TSHR (0.46) | NOS3NOS1NOS2HTR7RXRA | |
| SCHEMBL20176674 | 0.78 | THRB (0.44) | NOS3NOS1NOS2HTR7RXRA | |
| SCHEMBL13516712 | 0.75 | NCF1 (0.36) | NCF1RARARARBRARGPDE3B | |
| SCHEMBL13516710 | 0.75 | NCF1 (0.36) | NCF1RARARARBRARGPDE3B | |
| SCHEMBL7571391 | 0.74 | NCF1 (0.40) | NCF1PDE3BPDE3AP2RY12L3MBTL1 | |
| SCHEMBL25679564 | 0.74 | MCHR1 (0.40) | NOS3NOS1NOS2PDE3BPDE3A | |
| SCHEMBL14294218 | 0.73 | KDM4E (0.39) | NCF1NOS3NOS2RARARARB | |
| SCHEMBL7713782 | 0.73 | NPC1 (0.40) | NCF1RARARARBRARGL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2518060-A1 | NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE | Mochida Pharmaceutical Co., Ltd. (JP) | 2012-10-31 | — | — | EP | disclosed |