Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 3/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL23402527 | 0.95 | TP53 (0.43) | TP53TLR8KDM4EESR1ADORA3 | |
| SCHEMBL23399469 | 0.94 | CTSS (0.40) | TP53TLR8KDM4EESR1MEN1 | |
| SCHEMBL23398641 | 0.91 | TP53 (0.43) | TP53TLR8KDM4EESR1ADORA3 | |
| SCHEMBL23401397 | 0.91 | NPC1 (0.42) | TP53TLR8KDM4EADORA3ADORA2A | |
| SCHEMBL23403118 | 0.90 | TP53 (0.40) | TP53TLR8KDM4EESR1MEN1 | |
| SCHEMBL23398542 | 0.87 | TP53 (0.43) | TP53TLR8KDM4EESR1MEN1 | |
| SCHEMBL23400139 | 0.87 | TP53 (0.45) | TP53TLR8KDM4EESR1ADORA3 | |
| SCHEMBL23401117 | 0.87 | HSD11B1 (0.44) | ESR1ADORA3MEN1CYP1A2CYP2C9 | |
| SCHEMBL23401835 | 0.86 | TP53 (0.39) | TP53TLR8KDM4EADORA3ADORA2A | |
| SCHEMBL23403677 | 0.86 | TP53 (0.47) | TP53TLR8KDM4EESR1ADORA3 |
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 |