Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 13/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL438887 | 0.82 | MCHR1 (0.44) | NOS2NOS3NOS1MCHR1KDM4E | |
| SCHEMBL437498 | 0.79 | NOS2 (0.50) | NOS2NOS3NOS1MCHR1KDM4E | |
| SCHEMBL442077 | 0.77 | NR4A2 (0.45) | KDM4EALDH1A1NQO2PARP1PARP2 | |
| SCHEMBL440305 | 0.77 | MCHR1 (0.58) | MCHR1ASIC3 | |
| SCHEMBL437578 | 0.76 | MCHR1 (0.43) | NOS2NOS3NOS1MCHR1ASIC3 | |
| SCHEMBL438834 | 0.76 | NOS2 (0.50) | NOS2NOS3NOS1MCHR1KDM4E | |
| SCHEMBL440069 | 0.75 | NOS2 (0.41) | NOS2NOS3NOS1MCHR1ALDH1A1 | |
| SCHEMBL437548 | 0.74 | MCHR1 (0.49) | NOS2NOS3NOS1MCHR1KDM4E | |
| SCHEMBL440380 | 0.73 | ALDH1A1 (0.49) | NOS2NOS3NOS1MCHR1KDM4E | |
| SCHEMBL438849 | 0.72 | NOS3 (0.41) | NOS2NOS3NOS1MCHR1BACE1 |
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-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |