Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.39 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28670698 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAHPGDHIF1AKCNH2 | |
| SCHEMBL28664131 | 0.80 | RORC (0.39) | ALDH1A1LMNAHPGDHIF1AKCNH2 | |
| SCHEMBL18212447 | 0.80 | RIPK1 (0.49) | ALDH1A1LMNAHPGDHIF1AKCNH2 | |
| SCHEMBL28668669 | 0.77 | SLC18A3 (0.45) | ALDH1A1NPC1ATMMEN1KMT2A | |
| SCHEMBL28668671 | 0.77 | SLC18A3 (0.45) | ALDH1A1NPC1ATMMEN1KMT2A | |
| SCHEMBL28654086 | 0.76 | DPP8 (0.57) | HPGDKCNH2HRH3 | |
| SCHEMBL28654088 | 0.76 | DPP8 (0.57) | HPGDKCNH2HRH3 | |
| SCHEMBL30782004 | 0.74 | RAB9A (0.49) | ALDH1A1HPGDRAB9ANPC1USP30 | |
| SCHEMBL28659026 | 0.74 | HSD11B1 (0.37) | ALDH1A1HSD11B1 | |
| SCHEMBL28659028 | 0.74 | HSD11B1 (0.37) | ALDH1A1HSD11B1 |
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-107735088-B | Histone deacetylase inhibitors, compositions and methods of use thereof | CHDI基金会股份有限公司 | 2021-11-02 | — | — | CN | disclosed |