Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | DRD4 | P21917 | 3/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | CLPP | Q16740 | 4/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | GNRHR | P30968 | 1/20 | 0.47 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30130099 | 1.00 | MAPT (0.59) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914448 | 1.00 | MAPT (0.59) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914686 | 0.92 | CLPP (0.61) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914768 | 0.92 | CLPP (0.61) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL30130063 | 0.89 | DRD2 (0.57) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914661 | 0.89 | DRD2 (0.57) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914395 | 0.88 | CLPP (0.55) | DRD2DRD4DRD3CLPPKMT2A | |
| SCHEMBL28984488 | 0.88 | MAPT (0.55) | MAPTTHRBALDH1A1KAT2B | |
| SCHEMBL24914413 | 0.88 | CLPP (0.49) | MAPTTHRBDRD2DRD4DRD3 | |
| SCHEMBL24914443 | 0.88 | DRD2 (0.50) | DRD2DRD4DRD3CLPP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023284807-A1 | COMPOUND CONTAINING TETRAHYDRONAPHTHYRIDONE OR TETRAHYDROPYRIDOPYRIMIDINONE SKELETON, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2023-01-19 | — | — | WO | disclosed |