Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PNMT | P11086 | 4/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28038018 | 0.80 | SIRT2 (0.50) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL28016150 | 0.80 | ALDH1A1 (0.50) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL2083976 | 0.77 | CA12 (0.61) | ALDH1A1KMT2ASIRT2LMNAHTR2C | |
| SCHEMBL29360035 | 0.77 | CA12 (0.61) | ALDH1A1KMT2ASIRT2LMNAHTR2C | |
| SCHEMBL29191130 | 0.76 | SIRT2 (0.51) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL27975623 | 0.76 | SIRT2 (0.48) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL3885369 | 0.76 | SIRT2 (0.55) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL27660153 | 0.75 | SIRT2 (0.50) | ALDH1A1KMT2ASIRT2LMNAGAA | |
| SCHEMBL27888907 | 0.74 | HTR2C (0.58) | ALDH1A1SIRT2LMNAHTR2CDRD4 | |
| SCHEMBL27888908 | 0.74 | HTR2C (0.46) | ALDH1A1KMT2ASIRT2LMNAGAA |
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-118255685-A | Tricyclic compound, pharmaceutical composition and application thereof | 珂阑(上海)医药科技有限公司 | 2024-06-28 | — | — | CN | disclosed |