Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.51 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.51 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.51 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28661635 | 0.88 | CYP2C9 (0.51) | CYP2C9PTGDR2PTGER2PTGDRALDH1A1 | |
| SCHEMBL28667054 | 0.88 | PTGDR2 (0.51) | CYP2C9PTGDR2PTGER2PTGDRHDAC1 | |
| SCHEMBL28683408 | 0.85 | PTGDR2 (0.48) | CYP2C9PTGDR2PTGER2PTGDRHDAC1 | |
| SCHEMBL28672524 | 0.85 | PTGDR2 (0.65) | CYP2C9PTGDR2HDAC1HDAC6 | |
| SCHEMBL28670925 | 0.83 | HDAC6 (0.70) | HDAC1HDAC6 | |
| SCHEMBL28930608 | 0.82 | PTGDR2 (0.49) | CYP2C9PTGDR2PTGER2PTGDRHDAC1 | |
| SCHEMBL28683406 | 0.82 | CYP2C9 (0.65) | CYP2C9PTGDR2PTGER2PTGDRHDAC1 | |
| SCHEMBL28665679 | 0.82 | PTGDR2 (0.55) | CYP2C9PTGDR2HDAC1HDAC6 | |
| SCHEMBL28665682 | 0.81 | PTGDR2 (0.55) | CYP2C9PTGDR2 | |
| SCHEMBL28689645 | 0.81 | PTGDR2 (0.52) | CYP2C9PTGDR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113845522-A | Aminopeptidase N inhibitor and preparation method and application thereof | 山东省药学科学院 | 2021-12-28 | — | — | CN | claimed |
| CN-113845522-A | Aminopeptidase N inhibitor and preparation method and application thereof | 山东省药学科学院 | 2021-12-28 | — | — | CN | disclosed |