Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 15/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 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 | |
|---|---|---|---|---|
| SCHEMBL23480073 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL23479988 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL29851144 | 1.00 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL23466890 | 0.86 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPTCHEK1 | |
| SCHEMBL23480080 | 0.86 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPTCHEK1 | |
| SCHEMBL23480135 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL29170979 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL23480041 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL29170982 | 0.83 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HSD11B1MAPTCHEK1 | |
| SCHEMBL29170986 | 0.83 | LMNA (0.45) | ALDH1A1SMN1; SMN2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114929675-B | Adamantane derivatives as focal adhesion kinase inhibitors | 三进制药株式会社 | 2024-02-13 | — | — | CN | disclosed |
| CN-114929675-A | Novel adamantane derivatives as inhibitors of focal adhesion kinase | 三进制药株式会社 | 2022-08-19 | — | — | CN | disclosed |
| WO-2021111311-A2 | NOVEL ADAMANTANE DERIVATIVES AS INHIBITORS OF FOCAL ADHESION KINASE | 삼진제약주식회사 | 2021-06-10 | — | — | WO | disclosed |