Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLPP | Q16740 | 9/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | GNRHR | P30968 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30130128 | 1.00 | CLPP (0.54) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL24914459 | 0.94 | CLPP (0.61) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL30130162 | 0.94 | CLPP (0.61) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL30130047 | 0.93 | CLPP (0.54) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL24914723 | 0.93 | CLPP (0.54) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL24914407 | 0.93 | CLPP (0.61) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL24914677 | 0.93 | CLPP (0.61) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL30130065 | 0.93 | CLPP (0.61) | CLPPCYP3A4PTGDR2MEN1GAA | |
| SCHEMBL24914520 | 0.91 | CLPP (0.63) | CLPPCYP3A4MEN1GAAKMT2A | |
| SCHEMBL24914469 | 0.91 | CLPP (0.54) | CLPPCYP3A4PTGDR2MEN1GAA |
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 |