Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10180395 | 0.92 | CNR1 (0.50) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10181010 | 0.91 | DNMT3A (0.54) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10181141 | 0.90 | DNMT3A (0.48) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10181758 | 0.89 | DNMT3A (0.53) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL1154726 | 0.89 | RARB (0.55) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10181170 | 0.88 | DNMT3A (0.52) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL1154670 | 0.88 | PPARA (0.52) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10180483 | 0.88 | DNMT3A (0.46) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10180600 | 0.88 | DNMT3A (0.49) | DNMT3AAKR1C3HDAC1HDAC6NLRP3 | |
| SCHEMBL10182164 | 0.88 | NPC1 (0.48) | DNMT3AHDAC1HDAC6NLRP3CNR1 |
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-2215065-B1 | CCR10 ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2012-07-11 | — | — | EP | claimed |