Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | CXCR5 | P32302 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3004213 | 0.83 | GHSR (0.36) | MEN1KMT2ANPC1GAARAB9A | |
| SCHEMBL9782897 | 0.73 | KMT2A (0.32) | TP53KMT2A | |
| SCHEMBL29462779 | 0.69 | SDCBP (0.33) | SMN1; SMN2MEN1LMNAKMT2AHTT | |
| SCHEMBL2920161 | 0.69 | POLB (0.34) | TP53MEN1LMNAKMT2AHDAC9 | |
| SCHEMBL8627219 | 0.69 | SLC22A6 (0.43) | SMN1; SMN2NFKB1RAB9AMTNR1AMTNR1B | |
| SCHEMBL8627222 | 0.69 | SLC22A6 (0.43) | SMN1; SMN2NFKB1RAB9AMTNR1AMTNR1B | |
| SCHEMBL9793274 | 0.67 | CA1 (0.32) | — | |
| SCHEMBL8068895 | 0.66 | MAOA (0.35) | CXCR5HDAC9 | |
| SCHEMBL28924809 | 0.65 | HSD17B3 (0.35) | MTNR1AMTNR1B | |
| SCHEMBL7529245 | 0.64 | CA1 (0.35) | CXCR5HDAC9 |
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-108752232-B | Synthetic method of alpha-quaternary carbon amino acid | 四川大学 | 2021-03-19 | — | — | CN | disclosed |