Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | AOC2 | O75106 | 5/20 | 0.33 |
| ▸ | MAOA | P21397 | 5/20 | 0.33 |
| ▸ | MAOB | P27338 | 5/20 | 0.33 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL5477951 | 0.76 | NISCH (0.73) | NISCHGABRA1GABRB2HPGDTSHR | |
| SCHEMBL11285607 | 0.74 | HPGD (0.47) | NISCHDYRK1AIGF1RHSP90AB1GABRA1 | |
| SCHEMBL11470239 | 0.74 | NISCH (0.45) | NISCHDYRK1AIGF1RHSP90AB1HPGD | |
| SCHEMBL5695473 | 0.72 | CA2 (0.46) | NISCHGABRA1GABRB2HPGDTSHR | |
| SCHEMBL7616087 | 0.71 | NISCH (0.53) | NISCHHPGDTSHRCA2AOC2 | |
| SCHEMBL7086543 | 0.71 | NISCH (0.67) | NISCHDYRK1AIGF1RHSP90AB1HPGD | |
| SCHEMBL7490172 | 0.69 | NISCH (0.58) | NISCHDYRK1AIGF1RHSP90AB1GABRA1 | |
| SCHEMBL2597074 | 0.69 | NISCH (0.58) | NISCHDYRK1AHPGDTSHRCA2 | |
| SCHEMBL1045627 | 0.68 | NISCH (0.53) | NISCHCA2AOC2MAOAMAOB | |
| SCHEMBL3080227 | 0.68 | NISCH (0.56) | NISCHHPGDTSHRAOC2MAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-5919814-A | Heterocyclic compounds | ADIR ET COMPAGNIE (FR) | 1999-07-06 | — | — | US | disclosed |