Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYBB | P04839 | 1/20 | 0.48 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.48 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL23400699 | 0.92 | CYBB (0.41) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23403190 | 0.87 | ADORA2A (0.40) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23401541 | 0.86 | CYBB (0.59) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23401213 | 0.85 | CYBB (0.46) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23401682 | 0.83 | CYBB (0.47) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23402573 | 0.82 | CYBB (0.44) | CYBBNOX4NOX1ALDH1A1KDM4E | |
| SCHEMBL23403001 | 0.82 | CYBB (0.44) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23400974 | 0.82 | CYBB (0.55) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23402871 | 0.81 | CYBB (0.45) | CYBBNOX4NOX1ADORA2AADORA2B | |
| SCHEMBL23403363 | 0.80 | ADORA2A (0.36) | ADORA2AADORA2BALDH1A1KDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |