Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | STS | P08842 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MMP1 | P03956 | 2/20 | 0.48 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | MMP7 | P09237 | 1/20 | 0.48 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 2/20 | 0.48 |
| ▸ | CTSD | P07339 | 1/20 | 0.48 |
| ▸ | CTSE | P14091 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL7381166 | 0.93 | ALDH1A1 (0.69) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL2308747 | 0.91 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL8310166 | 0.90 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL20794854 | 0.88 | GPR119 (0.52) | ALDH1A1MAPTSMN1; SMN2TP53MEN1 | |
| SCHEMBL17605157 | 0.87 | DNMT3A (0.52) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL651891 | 0.87 | HTT (0.53) | ALDH1A1MAPTSMN1; SMN2STSMEN1 | |
| SCHEMBL17605155 | 0.87 | DNMT3A (0.52) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL652820 | 0.87 | HTT (0.53) | ALDH1A1MAPTSMN1; SMN2STSMEN1 | |
| SCHEMBL696779 | 0.87 | USP30 (0.56) | LMNASTSGPR119BACE1 | |
| SCHEMBL696778 | 0.87 | USP30 (0.56) | LMNASTSGPR119BACE1 |
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-116615427-A | Substituted macrocyclic compounds and related methods of treatment | 阿尔克姆斯有限公司 | 2023-08-18 | — | — | CN | disclosed |
| CN-114761412-A | Substituted macrocyclic compounds and related methods of treatment | 阿尔克姆斯有限公司 | 2022-07-15 | — | — | CN | disclosed |