Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 11/20 | 0.71 |
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | SCD | O00767 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL30927954 | 1.00 | CASR (0.71) | CASRNPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL29226445 | 1.00 | CASR (0.71) | CASRNPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL29033642 | 0.77 | CASR (0.46) | CASRNPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL7544923 | 0.75 | CASR (0.64) | CASRALDH1A1 | |
| SCHEMBL227210 | 0.71 | CASR (0.58) | CASRNPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL108180 | 0.71 | CASR (0.58) | CASRNPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL9906174 | 0.71 | CA4 (0.52) | SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL7128923 | 0.71 | CA1 (0.55) | MAPK1KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL30731274 | 0.71 | CYP1A2 (0.58) | NPC1RAB9ASMN1; SMN2GAATSHR | |
| SCHEMBL22224216 | 0.70 | CYP1A2 (0.60) | CASRSMN1; SMN2CYP1A2CYP3A4CYP2C19 |
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-117924156-A | Synthesis method of aza-aryl alcohol compound and chiral alpha-hydroxycarboxylic acid | 赣南师范大学 | 2024-04-26 | — | — | CN | disclosed |