Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | F10 | P00742 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28927060 | 0.87 | NPC1 (0.65) | HDAC8HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28248392 | 0.86 | HDAC6 (0.61) | HDAC8HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28248363 | 0.83 | NPC1 (0.68) | HDAC8HDAC6MAPK1NPC1RAB9A | |
| SCHEMBL19234504 | 0.83 | NPC1 (0.72) | MAPK1NPC1RAB9ASMN1; SMN2CA12 | |
| SCHEMBL13754018 | 0.83 | NPC1 (0.72) | MAPK1NPC1RAB9ASMN1; SMN2CA12 | |
| SCHEMBL8408236 | 0.81 | KDM4E (0.74) | NPC1RAB9ASMN1; SMN2CA12CA1 | |
| SCHEMBL23747492 | 0.81 | LSS (0.76) | MAPK1NPC1RAB9AMCHR1MEN1 | |
| SCHEMBL28643688 | 0.80 | KMT2A (0.60) | MAPK1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL10939703 | 0.79 | NPC1 (0.76) | MAPK1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL9767723 | 0.79 | NPC1 (0.76) | MAPK1NPC1RAB9ASMN1; SMN2MEN1 |
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-108623537-B | Synthesis and application of aromatic amine acetylcholinesterase inhibitor containing amine side chain | 中南大学 | 2021-11-12 | — | — | CN | disclosed |