Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.50 |
| ▸ | CTSK | P43235 | 4/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.48 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.48 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29182124 | 0.93 | SIGMAR1 (0.50) | IDO1SIGMAR1CTSKCHRNB2CHRNB4 | |
| SCHEMBL29182129 | 0.83 | CTSK (0.48) | IDO1SIGMAR1CTSKCHRNB2CHRNB4 | |
| SCHEMBL4583683 | 0.81 | POLB (0.65) | IDO1SIGMAR1CTSKCHRNB2CHRNB4 | |
| SCHEMBL6775479 | 0.81 | SIGMAR1 (0.54) | IDO1SIGMAR1CTSKCHRNB2CHRNB4 | |
| SCHEMBL15723464 | 0.80 | MAPT (0.60) | IDO1MEN1GAAKMT2ARECQL | |
| SCHEMBL4961185 | 0.80 | SIGMAR1 (0.62) | IDO1SIGMAR1MEN1GAAKMT2A | |
| SCHEMBL5468072 | 0.79 | NPSR1 (0.61) | IDO1SIGMAR1MEN1GAAKMT2A | |
| SCHEMBL22102023 | 0.79 | NPSR1 (0.61) | IDO1SIGMAR1MEN1GAAKMT2A | |
| SCHEMBL572740 | 0.78 | IDO1 (0.60) | IDO1SIGMAR1CTSKGAACTSS | |
| Alcohol SCHEMBL6778901 | 0.78 | CTSK (0.52) | IDO1SIGMAR1CTSKCHRNB2CHRNB4 |
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-117551004-A | Synthesis method of amino acid and amino alcohol compound | 四川大学 | 2024-02-13 | — | — | CN | disclosed |