Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 9/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | CRHBP | P24387 | 3/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2932177 | 1.00 | GAA (0.45) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892279 | 0.93 | GAA (0.42) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892445 | 0.91 | GAA (0.41) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892707 | 0.89 | GAA (0.39) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892141 | 0.79 | HTR2A (0.37) | GAAMAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL30003307 | 0.78 | GNRHR (0.42) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL10300131 | 0.78 | GNRHR (0.42) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892882 | 0.76 | ALDH1A1 (0.44) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL30226326 | 0.76 | ALDH1A1 (0.39) | GAAPKMMAPTKMT2AALDH1A1 | |
| SCHEMBL28892793 | 0.75 | RAB9A (0.38) | GAAPKMMAPTKMT2AALDH1A1 |
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-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |