Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5879641 | 0.83 | ALDH1A1 (0.69) | ALDH1A1LMNAMAPK1MAPTKMT2A | |
| SCHEMBL10682460 | 0.80 | ALDH1A1 (1.00) | ALDH1A1LMNAMAPK1MAPTKMT2A | |
| SCHEMBL11053417 | 0.78 | ALDH1A1 (0.76) | ALDH1A1LMNAMAPK1MAPTKMT2A | |
| SCHEMBL1200310 | 0.78 | ALDH1A1 (0.76) | ALDH1A1LMNAMAPK1MAPTKMT2A | |
| SCHEMBL16495194 | 0.77 | MMP2 (0.43) | KMT2AMEN1HTTMMP2MMP9 | |
| SCHEMBL27619654 | 0.76 | TDP1 (0.61) | ALDH1A1MAPTKMT2AMEN1HTT | |
| SCHEMBL96815 | 0.75 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTKMT2AGAA | |
| SCHEMBL1200410 | 0.74 | ALDH1A1 (0.69) | ALDH1A1LMNAMAPK1MAPTKMT2A | |
| SCHEMBL27418721 | 0.74 | ALDH1A1 (0.47) | ALDH1A1LMNAKMT2AGAAMEN1 | |
| SCHEMBL926503 | 0.74 | FFAR4 (0.43) | LMNAMAPK1KMT2AGAAMEN1 |
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-108947931-B | Thiazole amide compound, preparation method thereof, pharmaceutical composition and application | 中国科学院上海有机化学研究所 | 2023-07-07 | — | — | CN | disclosed |