Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.48 |
| ▸ | NOS3 | P29474 | 2/20 | 0.48 |
| ▸ | NOS1 | P29475 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 5/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10051193 | 0.88 | NOS3 (0.50) | NOS2NOS3NOS1MAPTKDM5B | |
| SCHEMBL13026558 | 0.82 | NOS2 (0.48) | NOS2NOS3NOS1BACE1MAPT | |
| SCHEMBL1187597 | 0.79 | NOS2 (0.57) | NOS2NOS3NOS1CYP1A2NPSR1 | |
| SCHEMBL3802657 | 0.78 | ALDH1A1 (0.46) | NOS2NOS3NOS1BACE1MAPT | |
| SCHEMBL9310993 | 0.78 | NOS2 (0.46) | NOS2NOS3NOS1BACE1MAPT | |
| SCHEMBL1187650 | 0.77 | KCNH2 (0.52) | NOS2NOS3NOS1ALDH1A1 | |
| SCHEMBL805465 | 0.76 | NOS3 (0.45) | NOS2NOS3NOS1MAPTHSD17B10 | |
| SCHEMBL1188625 | 0.76 | KCNH2 (0.55) | NOS2NOS3NOS1ALDH1A1 | |
| SCHEMBL1187318 | 0.76 | KCNH2 (0.55) | NOS2NOS3NOS1ALDH1A1 | |
| SCHEMBL1188792 | 0.76 | KCNH2 (0.55) | NOS2NOS3NOS1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108409672-B | Method for synthesizing polysubstituted pyrimidine under catalysis of copper salt | 安徽师范大学 | 2020-01-10 | — | — | CN | disclosed |
| EP-3495358-A1 | AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES | Bristol-Myers Squibb Company (US) | 2019-06-12 | — | — | EP | disclosed |