Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.34 |
| ▸ | HSF1 | Q00613 | 2/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5204329 | 0.78 | KDM4E (0.39) | NISCHHSF1BRD4HCRTR1HCRTR2 | |
| SCHEMBL5200333 | 0.77 | KDM4E (0.39) | NISCHHSF1BRD4HCRTR1HCRTR2 | |
| SCHEMBL5199466 | 0.71 | LMNA (0.46) | NISCHHSF1BRD4ADORA2AADORA1 | |
| SCHEMBL5200449 | 0.68 | BRD4 (0.37) | NISCHHSF1BRD4ADORA2AADORA1 | |
| SCHEMBL9026316 | 0.67 | NISCH (0.50) | NISCHHSF1BRD4ALDH1A1SMN1; SMN2 | |
| SCHEMBL23772037 | 0.65 | NISCH (0.44) | NISCHHSF1ADORA2AADORA1ALDH1A1 | |
| SCHEMBL5202337 | 0.64 | KDM4E (0.36) | HSF1HCRTR1HCRTR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL4554721 | 0.63 | NISCH (0.42) | NISCHHSF1ADORA2AADORA1ALDH1A1 | |
| SCHEMBL10721690 | 0.62 | SMN1; SMN2 (0.41) | NISCHALDH1A1SMN1; SMN2 | |
| SCHEMBL5200407 | 0.62 | KDM4E (0.41) | ADORA2AADORA1ALDH1A1SMPD3 |
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-1817030-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | Kalypsys, Inc. (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006060424-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | KALYPSYS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |