Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | NAE1 | Q13564 | 2/20 | 0.36 |
| ▸ | UBA3 | Q8TBC4 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL23456264 | 1.00 | EGFR (0.44) | EGFRERBB3ADORA3F2NAE1 | |
| SCHEMBL30960669 | 0.88 | EGFR (0.48) | EGFRERBB3ADORA3F2NAE1 | |
| SCHEMBL23456613 | 0.88 | EGFR (0.48) | EGFRERBB3ADORA3F2NAE1 | |
| SCHEMBL27250613 | 0.83 | EGFR (0.45) | EGFRERBB3ADORA3NAE1UBA3 | |
| SCHEMBL22401445 | 0.83 | SLC6A1 (0.33) | — | |
| SCHEMBL23456103 | 0.83 | SLC6A1 (0.33) | — | |
| SCHEMBL23456000 | 0.82 | EGFR (0.41) | EGFRERBB3ADORA3NAE1UBA3 | |
| SCHEMBL23456083 | 0.80 | SLC6A1 (0.33) | RAB9A | |
| SCHEMBL25440003 | 0.76 | P2RY1 (0.45) | — | |
| SCHEMBL30608503 | 0.74 | P2RY1 (0.42) | — |
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-3707151-A1 | STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING | Takeda Pharmaceutical Company Limited (JP) | 2020-09-16 | — | — | EP | disclosed |