Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 4/20 | 0.42 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20219392 | 0.85 | CYP1A2 (0.46) | MRGPRX4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL15469973 | 0.84 | CYP1A2 (0.54) | MRGPRX4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL23472599 | 0.74 | CYP1A2 (0.44) | SMN1; SMN2CYP1A2CYP2D6CYP3A4TLR8 | |
| SCHEMBL13195812 | 0.73 | TLR7 (0.59) | MRGPRX4NPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL23472368 | 0.73 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP3A4TLR8TLR7 | |
| SCHEMBL23472382 | 0.72 | TLR8 (0.43) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL20219500 | 0.71 | CYP1A2 (0.47) | SMN1; SMN2CYP1A2CYP2D6CYP3A4TLR8 | |
| SCHEMBL13195688 | 0.70 | CYP1A2 (0.51) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL23472224 | 0.70 | GPBAR1 (0.49) | SMN1; SMN2CYP1A2CYP2D6CYP3A4TLR7 | |
| SCHEMBL23472700 | 0.69 | LMNA (0.38) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2D6 |
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-3330257-A1 | PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS | Janssen Sciences Ireland UC (IE) | 2018-06-06 | — | — | EP | disclosed |