Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 9/20 | 0.41 |
| ▸ | KRAS | P01116 | 1/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20219370 | 0.94 | CYP2D6 (0.40) | CRHR1TLR8CYP2D6DRD1HTR2A | |
| SCHEMBL20413293 | 0.94 | CYP2D6 (0.40) | CRHR1TLR8CYP2D6DRD1HTR2A | |
| SCHEMBL20219523 | 0.92 | CRHR1 (0.40) | CRHR1TLR8TLR7 | |
| SCHEMBL20413264 | 0.92 | CRHR1 (0.40) | CRHR1TLR8TLR7 | |
| SCHEMBL20219720 | 0.87 | TLR7 (0.46) | TLR8TLR7KCNH2 | |
| SCHEMBL23472270 | 0.85 | TLR8 (0.41) | CRHR1TLR8TLR7KCNH2 | |
| SCHEMBL20413266 | 0.84 | TRPM8 (0.41) | CRHR1TLR8TAS1R3TAS1R1TLR7 | |
| SCHEMBL20413267 | 0.82 | KCNH2 (0.39) | TLR8CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL23472215 | 0.81 | TLR8 (0.38) | TLR8CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL20219377 | 0.81 | TLR8 (0.38) | TLR8CYP2D6DRD1HTR2AADORA1 |
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-3590928-B1 | PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) | 2021-06-09 | — | — | EP | disclosed |