Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | RAF1 | P04049 | 8/20 | 0.34 |
| ▸ | BRAF | P15056 | 8/20 | 0.34 |
| ▸ | MTOR | P42345 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | HCK | P08631 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 2/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23994803 | 1.00 | SMPD3 (0.37) | SMPD3CNR2RAF1BRAFMTOR | |
| SCHEMBL23993202 | 0.96 | RAF1 (0.36) | SMPD3RAF1BRAFMTORPIK3CD | |
| SCHEMBL30224920 | 0.96 | RAF1 (0.36) | SMPD3RAF1BRAFMTORPIK3CD | |
| SCHEMBL23992886 | 0.94 | RAF1 (0.33) | SMPD3CNR2RAF1BRAFMTOR | |
| SCHEMBL23994479 | 0.92 | HSD11B1 (0.35) | SMPD3CNR2RAF1BRAFMTOR | |
| SCHEMBL30224260 | 0.92 | HSD11B1 (0.35) | SMPD3CNR2RAF1BRAFMTOR | |
| SCHEMBL23993503 | 0.91 | PDE1B (0.33) | RAF1BRAFMTORPIK3CDABL1 | |
| SCHEMBL23994419 | 0.91 | HSD11B1 (0.35) | SMPD3RAF1BRAFMTORPIK3CD | |
| SCHEMBL23994039 | 0.90 | SYK (0.34) | CNR2RAF1BRAFMTORPIK3CD | |
| SCHEMBL30224144 | 0.90 | SYK (0.34) | CNR2RAF1BRAFMTORPIK3CD |
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-4143194-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2023-03-08 | — | — | EP | disclosed |