Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL29994919 | 1.00 | KAT2B (0.31) | KAT2BPDE2A | |
| SCHEMBL20436603 | 0.81 | PDE2A (0.31) | PDE2A | |
| SCHEMBL20416694 | 0.76 | NLRP3 (0.34) | — | |
| SCHEMBL29100970 | 0.75 | ACE2 (0.36) | — | |
| SCHEMBL14270118 | 0.75 | KAT2B (0.36) | KAT2B | |
| SCHEMBL20096042 | 0.72 | KAT2B (0.35) | KAT2B | |
| SCHEMBL16401940 | 0.72 | HTR2A (0.39) | — | |
| SCHEMBL28770884 | 0.70 | IDO1 (0.46) | KAT2BPDE2A | |
| SCHEMBL28698315 | 0.70 | CYP4F2 (0.40) | PDE2A | |
| SCHEMBL29467954 | 0.70 | CYP4F2 (0.40) | PDE2A |
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-116981669-A | Pyrimidine or pyrido heterocyclic adenosine receptor inhibitor, preparation method and application thereof | 上海齐鲁制药研究中心有限公司 | 2023-10-31 | — | — | CN | disclosed |