Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.35 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.35 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.35 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.35 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.35 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20219723 | 0.90 | ALDH1A1 (0.38) | ALDH1A1POLBTLR7TLR8 | |
| SCHEMBL20219346 | 0.88 | ALDH1A1 (0.40) | ALDH1A1POLBTLR7TLR8GAK | |
| SCHEMBL23472512 | 0.88 | TLR7 (0.38) | ALDH1A1POLBPDE5ATLR7TLR8 | |
| SCHEMBL15470030 | 0.88 | TLR8 (0.45) | ALDH1A1TLR7TLR8CYP1A2CYP3A4 | |
| SCHEMBL23472466 | 0.86 | CYP1A2 (0.45) | ALDH1A1POLBPDE5ANPC1TLR7 | |
| SCHEMBL20219327 | 0.84 | MAPK1 (0.44) | ALDH1A1NPC1TLR7TLR8CYP1A2 | |
| SCHEMBL20219715 | 0.81 | HDAC3 (0.46) | NPC1TLR7 | |
| SCHEMBL13195680 | 0.81 | FLT3 (0.41) | ALDH1A1POLBTLR7TLR8CYP1A2 | |
| SCHEMBL23472281 | 0.81 | TLR7 (0.38) | TLR7TLR8 | |
| SCHEMBL23472288 | 0.80 | TLR8 (0.38) | TLR7TLR8CYP3A4KDM4E |
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 2 patents. 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 |
| EP-3330257-A1 | PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | Janssen Sciences Ireland UC (IE) | 2018-06-06 | — | — | EP | disclosed |