Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | PYGL | P06737 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 2/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.38 |
| ▸ | TOP2A | P11388 | 2/20 | 0.38 |
| ▸ | TTK | P33981 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | TPMT | P51580 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | MAX | P61244 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29189691 | 0.88 | PDE4B (0.44) | PDE4BLRRK2PYGLHSP90AB1TOP2A | |
| SCHEMBL12492024 | 0.78 | PDE4B (0.46) | PDE4BKMOCA12CA1CA2 | |
| SCHEMBL16618391 | 0.78 | KMT2A (0.42) | PDE4BKMOCA12CA1CA2 | |
| SCHEMBL29189599 | 0.77 | PDE4B (0.43) | PDE4BKMOCA12CA1CA2 | |
| SCHEMBL15573836 | 0.77 | CA12 (0.63) | PDE4BCA12CA1CA2CA4 | |
| SCHEMBL24752113 | 0.76 | PDE4B (0.40) | PDE4BKMOCA12CA1CA2 | |
| SCHEMBL2593591 | 0.75 | RAB9A (0.55) | PDE4BKMOCA12CA1CA2 | |
| SCHEMBL29189474 | 0.75 | PDE5A (0.46) | PDE4BPYGLHSP90AB1TOP2A | |
| SCHEMBL29189597 | 0.74 | CASP6 (0.56) | HCAR3MYCMAX | |
| SCHEMBL20357330 | 0.72 | PDE4B (0.37) | PDE4BKMO |
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 |
|---|---|---|---|---|---|---|---|
| CN-117881681-A | Substituted pyrrolo [2,3-d ] pyrimidines, their preparation and their therapeutic use | 赛诺菲 | 2024-04-12 | — | — | CN | disclosed |