Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | LATS1 | O95835 | 2/20 | 0.38 |
| ▸ | LATS2 | Q9NRM7 | 2/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDM6B | O15054 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23472511 | 0.88 | CHRNB2 (0.43) | CYP2D6CYP3A4TLR7SMN1; SMN2TSHR | |
| SCHEMBL20219444 | 0.88 | TLR7 (0.42) | CYP3A4LATS1LATS2TLR7LMNA | |
| SCHEMBL20219572 | 0.84 | CYP2D6 (0.43) | CYP2D6CYP3A4LATS1LATS2TLR7 | |
| SCHEMBL13195834 | 0.83 | L3MBTL1 (0.47) | CYP2D6CYP3A4TLR7TLR8CYP1A2 | |
| SCHEMBL23472425 | 0.80 | CASP6 (0.41) | CYP2D6CYP3A4TLR7LMNASMN1; SMN2 | |
| SCHEMBL20219702 | 0.80 | ALDH1A1 (0.35) | TLR7ALDH1A1TLR8 | |
| SCHEMBL20219322 | 0.80 | CYP1A2 (0.42) | CYP2D6CYP3A4TLR7LMNASMN1; SMN2 | |
| SCHEMBL23472658 | 0.79 | HTR1A (0.47) | TLR8 | |
| SCHEMBL20219428 | 0.79 | TLR7 (0.40) | CYP2D6CYP3A4TLR7KDM4EALDH1A1 | |
| SCHEMBL20219350 | 0.78 | ALDH1A1 (0.32) | TLR7ALDH1A1TLR8 |
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 |