Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6917552 | 0.87 | NAMPT (0.45) | NAMPTPTPN2PTPN1PTPN6ALDH1A1 | |
| SCHEMBL12609789 | 0.85 | HTT (0.46) | EPHA2SMN1; SMN2MAPTHTTERBB2 | |
| SCHEMBL12609787 | 0.85 | HTT (0.46) | EPHA2SMN1; SMN2MAPTHTTERBB2 | |
| SCHEMBL497161 | 0.83 | USP2 (0.46) | NAMPTPTPN2PTPN1PTPN6USP2 | |
| SCHEMBL323889 | 0.83 | USP2 (0.46) | NAMPTPTPN2PTPN1PTPN6USP2 | |
| SCHEMBL12609593 | 0.83 | MEN1 (0.44) | NAMPTPTPN2PTPN1PTPN6ALDH1A1 | |
| SCHEMBL12609595 | 0.83 | MEN1 (0.44) | NAMPTPTPN2PTPN1PTPN6ALDH1A1 | |
| SCHEMBL31385973 | 0.83 | KMT2A (0.46) | NAMPTALDH1A1USP2SMN1; SMN2PDE4B | |
| SCHEMBL15109716 | 0.83 | KMT2A (0.46) | NAMPTALDH1A1USP2SMN1; SMN2PDE4B | |
| SCHEMBL15109717 | 0.83 | KMT2A (0.46) | NAMPTALDH1A1USP2SMN1; SMN2PDE4B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023079128-A1 | CATALYTIC HYDROGENATION OF AROMATIC NITRO COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-05-11 | — | — | WO | disclosed |