Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 5/20 | 0.50 |
| ▸ | NOS3 | P29474 | 3/20 | 0.46 |
| ▸ | NOS2 | P35228 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL453886 | 0.81 | NOS1 (0.53) | NOS1NOS3NOS2MEN1KMT2A | |
| SCHEMBL3290310 | 0.67 | MEN1 (0.56) | NOS1NOS3NOS2MEN1KMT2A | |
| SCHEMBL6643315 | 0.67 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL2515680 | 0.66 | NOS1 (0.38) | NOS1NOS3NOS2MEN1KMT2A | |
| SCHEMBL7505121 | 0.65 | NOS1 (0.52) | NOS1NOS3NOS2MEN1KMT2A | |
| SCHEMBL10293743 | 0.63 | NOS3 (0.42) | NOS1NOS3NOS2 | |
| SCHEMBL8309094 | 0.63 | NOS3 (0.31) | NOS1NOS3NOS2 | |
| SCHEMBL6644831 | 0.63 | NOS1 (1.00) | NOS1NOS3NOS2 | |
| SCHEMBL6599478 | 0.62 | SIGMAR1 (0.43) | MEN1KMT2AALDH1A1 | |
| Water SCHEMBL6608061 | 0.61 | MAOA (0.32) | — |
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-9852896-B2 | Method and apparatus for contained-electrospray for use in mass spectrometry and droplet reactions | OHIO STATE INNOVATION FOUNDATION (US) | 2017-12-26 | — | — | US | disclosed |