Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RBP4 | P02753 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9009717 | 0.77 | USP2 (1.00) | USP2NPSR1GAAMEN1KMT2A | |
| SCHEMBL4808643 | 0.74 | NPSR1 (0.70) | USP2NPSR1GAAMEN1KMT2A | |
| SCHEMBL27913352 | 0.71 | NPSR1 (0.49) | NPSR1GAAMEN1KMT2APOLB | |
| SCHEMBL8902905 | 0.70 | NPSR1 (0.49) | NPSR1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL17099130 | 0.70 | NPSR1 (0.49) | NPSR1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL6319111 | 0.69 | NPSR1 (0.55) | NPSR1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL9000877 | 0.69 | USP2 (0.68) | USP2NPSR1GAAMEN1KMT2A | |
| SCHEMBL3170633 | 0.69 | NPSR1 (0.59) | NPSR1GAAMEN1KMT2APOLB | |
| SCHEMBL3180504 | 0.68 | NPSR1 (0.58) | NPSR1GAAMEN1KMT2AALDH1A1 | |
| Propionic Acid SCHEMBL28419513 | 0.68 | ALDH1A1 (0.48) | NPSR1GAAALDH1A1MAPTSMN1; SMN2 |
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-104710347-B | (R) synthetic method of the tetrahydrochysene piperidines of 1 benzyl, 3 methyl 1,2,3,6 | 杭州澳赛诺生物科技有限公司 | 2018-01-16 | — | — | CN | disclosed |