Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 4/20 | 0.38 |
| ▸ | PRMT3 | O60678 | 2/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 4/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1834699 | 0.76 | ROCK1 (0.43) | NAMPTKEAP1NFE2L2ROCK2 | |
| SCHEMBL12077354 | 0.76 | ROCK1 (0.43) | NAMPTKEAP1NFE2L2ROCK2 | |
| SCHEMBL13771605 | 0.68 | NAMPT (0.59) | NAMPTKEAP1NFE2L2EPHX1KMT2A | |
| SCHEMBL13771485 | 0.68 | NAMPT (0.59) | NAMPTKEAP1NFE2L2EPHX1KMT2A | |
| SCHEMBL13771477 | 0.66 | NAMPT (0.58) | NAMPTKEAP1NFE2L2EPHX1KMT2A | |
| SCHEMBL12094459 | 0.66 | TPSAB1 (0.52) | EPHX1 | |
| SCHEMBL1837388 | 0.66 | TPSAB1 (0.52) | EPHX1 | |
| SCHEMBL13771329 | 0.66 | NAMPT (0.44) | NAMPTKEAP1NFE2L2EPHX1CYP19A1 | |
| SCHEMBL13771478 | 0.66 | NAMPT (0.44) | NAMPTKEAP1NFE2L2EPHX1CYP19A1 | |
| SCHEMBL12077957 | 0.64 | NAMPT (0.53) | NAMPTROCK2 |
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-9006426-B2 | Squaric acid derivatives as inhibitors of the nicotinamide | TOPOTARGET A/S (DK) | 2015-04-14 | — | — | US | claimed |