Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.39 |
| ▸ | INMT | O95050 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6338204 | 0.92 | ELANE (0.38) | ACEELANEMEN1POLBMAPT | |
| SCHEMBL366968 | 0.86 | KCNH2 (0.40) | MEN1POLBKMT2AKCNH2FAAH | |
| SCHEMBL23001009 | 0.83 | ACE (0.41) | ACEINMTALDH1A1 | |
| SCHEMBL6205796 | 0.82 | MEN1 (0.36) | ACEELANEMEN1KMT2ABCHE | |
| SCHEMBL28017368 | 0.82 | ACE (0.38) | ACEKMT2AKCNH2FAAH | |
| SCHEMBL3226035 | 0.76 | ACE (0.39) | ACEKCNH2FAAH | |
| SCHEMBL28845477 | 0.73 | ALDH1A1 (0.39) | ACEPOLBALDH1A1L3MBTL1 | |
| SCHEMBL5109105 | 0.72 | ACE (0.62) | ACEELANEPOLBMAPTKMT2A | |
| SCHEMBL27658289 | 0.72 | ACE (0.38) | ACEELANEALDH1A1ITGB3ITGA2B | |
| SCHEMBL28905056 | 0.71 | S1PR1 (0.40) | BCHE |
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-105524043-B | Lactams histon deacetylase (HDAC) inhibitor | 中国药科大学 | 2018-08-14 | — | — | CN | disclosed |
| CN-105524043-A | Lactam histone deacetylase inhibitors | UNIV CHINA PHARMA | 2016-04-27 | — | — | CN | disclosed |