Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GPX4 | P36969 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28038889 | 1.00 | TP53 (0.62) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL28039146 | 1.00 | TP53 (0.62) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL28823423 | 1.00 | TP53 (0.62) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL28038835 | 0.95 | TP53 (0.54) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL29837177 | 0.84 | TP53 (0.43) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL4031047 | 0.83 | TRPM8 (0.44) | TP53ALDH1A1L3MBTL1CYP3A4LMNA | |
| SCHEMBL30443001 | 0.83 | CYP3A4 (0.54) | TP53ALDH1A1L3MBTL1CYP3A4LMNA | |
| SCHEMBL12117477 | 0.83 | CYP3A4 (0.54) | TP53ALDH1A1L3MBTL1CYP3A4LMNA | |
| SCHEMBL27902452 | 0.83 | ALDH1A1 (0.43) | TP53ALDH1A1NPC1RAB9APAX8 | |
| SCHEMBL28823462 | 0.78 | NCEH1 (0.41) | TP53ALDH1A1NPC1RAB9APAX8 |
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-104981249-A | Antimicrobial compounds, their synthesis and applications thereof | SEC DEP FOR HEALTH | 2015-10-14 | — | — | CN | disclosed |