Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 5/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 3/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28606126 | 0.78 | MMP8 (0.49) | CASP1MMP8MMP14 | |
| SCHEMBL1464024 | 0.72 | ATM (0.52) | CASP1ATMCYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL18803174 | 0.70 | CTSL (0.52) | ALDH1A1CYP3A4TSHRCTSLCTSS | |
| SCHEMBL23881683 | 0.70 | MMP8 (0.52) | CASP1MMP8MMP14 | |
| SCHEMBL28629890 | 0.69 | ATM (0.49) | CASP1ATMCYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7087075 | 0.69 | KYNU (0.59) | CASP1ALDH1A1CTSLCTSSCTSK | |
| SCHEMBL5970693 | 0.69 | FOLH1 (0.56) | CASP1ALDH1A1CTSLCTSSCTSK | |
| SCHEMBL6299667 | 0.69 | FOLH1 (0.56) | CASP1ALDH1A1CTSLCTSSCTSK | |
| SCHEMBL11053442 | 0.69 | KYNU (0.59) | CASP1ALDH1A1CTSLCTSSCTSK | |
| SCHEMBL220498 | 0.69 | FOLH1 (0.56) | CASP1ALDH1A1CTSLCTSSCTSK |
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-113166182-A | Aminopeptidase A inhibitor and pharmaceutical composition comprising the same | 量子基因公司 | 2021-07-23 | — | — | CN | disclosed |