Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | NPY1R | P25929 | 1/20 | 0.52 |
| ▸ | NPY2R | P49146 | 1/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.51 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.51 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.51 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.51 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.51 |
| ▸ | GABRP | O00591 | 1/20 | 0.51 |
| ▸ | GABRD | O14764 | 1/20 | 0.51 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.51 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.51 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.51 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.51 |
| ▸ | GABRE | P78334 | 1/20 | 0.51 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29232889 | 0.82 | MAPT (0.54) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL29232885 | 0.79 | NGFR (0.47) | KMT2AGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL29232879 | 0.76 | MAPT (0.51) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL4390047 | 0.76 | DYRK1A (0.52) | MEN1KMT2APOLBALDH1A1GABRA1 | |
| SCHEMBL29232880 | 0.74 | MAPT (0.51) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL10707601 | 0.74 | GABRA1 (0.47) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL29233022 | 0.73 | MAPT (0.50) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL27981607 | 0.73 | GABRA1 (0.67) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL29540314 | 0.72 | GABRA1 (0.70) | MEN1KMT2APOLBALDH1A1PKM | |
| SCHEMBL155013 | 0.72 | GABRA1 (0.70) | MEN1KMT2APOLBALDH1A1PKM |
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-118206560-A | Lipoic acid derivative containing pyridazino indole structure, and preparation method and application thereof | 浙江中医药大学 | 2024-06-18 | — | — | CN | disclosed |