Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 15/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.37 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21552487 | 0.84 | CTSA (0.47) | CTSA | |
| SCHEMBL10862235 | 0.76 | CTSA (0.42) | CTSA | |
| SCHEMBL13075752 | 0.75 | CYP19A1 (0.40) | — | |
| SCHEMBL21552119 | 0.73 | CTSA (0.45) | CTSA | |
| SCHEMBL27787271 | 0.72 | ALDH1A1 (0.40) | CTSA | |
| SCHEMBL21552311 | 0.71 | NR3C1 (0.41) | CTSA | |
| SCHEMBL19257958 | 0.71 | PTPRB (0.47) | CTSACYP2D6CYP2C19 | |
| SCHEMBL28622173 | 0.70 | ALDH1A1 (0.46) | CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL21525583 | 0.69 | CTSA (0.50) | CTSA | |
| SCHEMBL10669573 | 0.69 | CTSA (0.49) | CTSA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019216742-A1 | NOVEL COMPOUND EXHIBITING ENTEROPEPTIDASE INHIBITORY ACTIVITY | 주식회사 엘지화학 (KR) | 2019-11-14 | — | — | WO | disclosed |