Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 13/20 | 0.43 |
| ▸ | CD38 | P28907 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 3/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3558930 | 0.82 | NOS2 (0.43) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL3559596 | 0.81 | NOS2 (0.42) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL13037152 | 0.77 | ALDH1A1 (0.42) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL3573524 | 0.73 | NOS2 (0.46) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL3563653 | 0.73 | NOS2 (0.46) | NOS2CD38CYP1A2CYP2C19NOS1 | |
| SCHEMBL3558712 | 0.73 | NOS2 (0.46) | NOS2CD38CYP1A2CYP2C19NOS1 | |
| SCHEMBL3568833 | 0.72 | NOS2 (0.40) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL3568834 | 0.72 | NOS2 (0.40) | NOS2CD38CYP1A2CYP2C19 | |
| SCHEMBL13037188 | 0.71 | LMNA (0.50) | NOS2CYP1A2CYP2C19 | |
| SCHEMBL3559939 | 0.70 | NOS2 (0.46) | NOS2CD38CYP1A2CYP2C19NOS1 |
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-7825256-B2 | Inducible nitric oxide synthase dimerization inhibitors | KALYPSYS, INC. (US) | 2010-11-02 | — | — | US | disclosed |