Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL6954651 | 1.00 | NOS3 (0.39) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL2688028 | 0.79 | NOS3 (0.43) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL13772782 | 0.74 | NOS3 (0.39) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL11400291 | 0.71 | NOS3 (0.37) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL13772751 | 0.70 | NOS3 (0.39) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL13370509 | 0.68 | — | — | |
| SCHEMBL12653912 | 0.67 | NOS3 (0.34) | NOS3NOS1NOS2 | |
| SCHEMBL10496254 | 0.67 | NOS3 (0.34) | NOS3NOS1NOS2ALDH1A1GAA | |
| SCHEMBL27560675 | 0.66 | — | — | |
| SCHEMBL6440092 | 0.65 | — | — |
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-2011023677-A1 | TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS | NOVARTIS AG (CH) | 2011-03-03 | — | — | WO | disclosed |