Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 7/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 6/20 | 0.32 |
| ▸ | HTR2B | P41595 | 5/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 4/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25005554 | 0.86 | KCNJ6 (0.34) | CHEK1BTK | |
| SCHEMBL25004510 | 0.82 | CHEK1 (0.33) | CHEK1 | |
| SCHEMBL25004871 | 0.76 | ACSS2 (0.39) | HTR2CHTR2BHTR2A | |
| SCHEMBL23995200 | 0.76 | HTR2C (0.34) | SLC6A4SLC6A2SLC6A3HTR2CHTR2B | |
| SCHEMBL23995222 | 0.72 | NR3C1 (0.35) | PDE10A | |
| SCHEMBL23992773 | 0.71 | SLC6A4 (0.34) | SLC6A4SLC6A2SLC6A3HTR2CHTR2B | |
| SCHEMBL23992782 | 0.71 | EGFR (0.37) | SLC6A4PDE10AHTR2CHTR2BHTR2A | |
| SCHEMBL23993198 | 0.70 | HDAC1 (0.49) | CHEK1BTK | |
| SCHEMBL30224224 | 0.70 | HDAC1 (0.49) | CHEK1BTK | |
| SCHEMBL23993004 | 0.70 | ESR1 (0.37) | SLC6A4HTR2CHTR2BHTR2ACHRNB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222522-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2021-11-04 | — | — | WO | disclosed |