Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GALR3 | O60755 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.32 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29861012 | 0.88 | ALDH1A1 (0.31) | ALDH1A1GALR3CHRM5CHRM1CHRM3 | |
| SCHEMBL28839404 | 0.86 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL29860797 | 0.86 | HTT (0.31) | ALDH1A1HTT | |
| SCHEMBL27466851 | 0.83 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL27637715 | 0.81 | HTT (0.32) | ALDH1A1GALR3CHRM5CHRM1CHRM3 | |
| SCHEMBL27543877 | 0.81 | HTT (0.32) | ALDH1A1GALR3CHRM5CHRM1CHRM3 | |
| SCHEMBL25277676 | 0.74 | CYP1A2 (0.30) | — | |
| SCHEMBL1697992 | 0.72 | ALOX15 (0.39) | ALDH1A1GALR3CHRM5CHRM1CHRM3 | |
| SCHEMBL5692021 | 0.72 | GAA (0.36) | ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL31289958 | 0.72 | ALDH1A1 (0.33) | ALDH1A1GALR3CHRM5CHRM1CHRM3 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114907365-B | Influenza virus inhibitor and application thereof | 扬子江药业集团有限公司 | 2023-12-01 | — | — | CN | disclosed |
| CN-117120441-A | Influenza virus inhibitor and application thereof | 扬子江药业集团有限公司 | 2023-11-24 | — | — | CN | disclosed |
| WO-2022171198-A1 | INFLUENZA VIRUS INHIBITOR AND USE THEREOF | 扬子江药业集团有限公司 | 2022-08-18 | — | — | WO | disclosed |
| CN-114907365-A | Influenza virus inhibitor and application thereof | 扬子江药业集团有限公司 | 2022-08-16 | — | — | CN | disclosed |
| CN-100367946-C | Gabapentin analogs for the treatment of fibromyalgia and other disorders | WARNER LAMBERT CO (US) | 2008-02-13 | — | — | CN | disclosed |
| CN-1303059-C | Cyclic amino acids and derivatives thereof useful as pharmaceutical agents | WARNER LAMBERT CO (US) | 2007-03-07 | — | — | CN | disclosed |
| CN-1720038-A | Gabapentin analogs for the treatment of fibromyalgia and other disorders | WARNER LAMBERT CO (US) | 2006-01-11 | — | — | CN | disclosed |
| CN-1500773-A | Cyclic amino acids and derivatives thereof useful as pharmaceutical agents | ��ʲ | 2004-06-02 | — | — | CN | disclosed |
| CN-1138755-C | Cyclic amino acids and derivatives thereof as pharmaceuticals | ��ʲ | 2004-02-18 | — | — | CN | disclosed |
| CN-1276784-A | Cyclic amino acids and their organisms as medicaments | WARNER LAMBERT CO (US) | 2000-12-13 | — | — | CN | disclosed |