Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.54 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1866151 | 0.93 | SMN1; SMN2 (0.67) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 | |
| SCHEMBL1866150 | 0.93 | SMN1; SMN2 (0.67) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 | |
| SCHEMBL12373561 | 0.93 | SMN1; SMN2 (0.67) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 | |
| SCHEMBL7981835 | 0.87 | CHRNA1 (0.69) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 | |
| SCHEMBL9408645 | 0.87 | CHRNA1 (0.69) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 | |
| SCHEMBL9408589 | 0.81 | SMN1; SMN2 (0.73) | SMN1; SMN2CHRNA1CHRNA3CHRNA7MAPT | |
| SCHEMBL9408584 | 0.81 | SMN1; SMN2 (0.73) | SMN1; SMN2CHRNA1CHRNA3CHRNA7MAPT | |
| SCHEMBL10738344 | 0.81 | SMN1; SMN2 (0.69) | SMN1; SMN2CHRNA1CHRNA3CHRNA7MAPT | |
| SCHEMBL10738351 | 0.81 | SMN1; SMN2 (0.69) | SMN1; SMN2CHRNA1CHRNA3CHRNA7MAPT | |
| SCHEMBL28402275 | 0.81 | SMN1; SMN2 (0.62) | SMN1; SMN2CHRNA1CHRNA3CHRNA7SIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106518885-B | 1,3- diazacyclos and quaternized pyridinium salt compound and its midbody compound, preparation method and application | 云南大学 | 2018-10-16 | — | — | CN | disclosed |
| CN-106518885-A | 1,3-diazacyclopyridine quaternary ammonium salt compound, intermediate compound thereof as well as preparation methods and applications of compounds | 云南大学 | 2017-03-22 | — | — | CN | disclosed |