Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR183 | P32249 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28637731 | 0.90 | GABRA5 (0.39) | MAPK1NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL28627863 | 0.90 | ALDH1A1 (0.42) | MAPK1NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL28634554 | 0.90 | HSD17B10 (0.39) | MAPK1NPC1RAB9AKMT2AGPR183 | |
| SCHEMBL28647079 | 0.89 | HDAC1 (0.39) | MAPK1NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL22218425 | 0.87 | ALDH1A1 (0.41) | MAPK1NPC1RAB9AKMT2AGPR183 | |
| SCHEMBL22218426 | 0.87 | MAPK1 (0.35) | MAPK1NPC1RAB9AKMT2AGPR183 | |
| SCHEMBL28641834 | 0.86 | NPC1 (0.43) | NPC1RAB9AKMT2AHDAC1HDAC8 | |
| SCHEMBL28634158 | 0.85 | ALDH1A1 (0.41) | MAPK1NPC1RAB9AKDM4EMLYCD | |
| SCHEMBL28641714 | 0.83 | HTR1A (0.42) | KMT2ASTAT3HDAC1HDAC8HDAC6 | |
| SCHEMBL28627867 | 0.83 | HDAC1 (0.39) | MAPK1NPC1RAB9AKMT2AKDM4E |
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-108137518-B | 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same | 株式会社钟根堂 | 2021-08-31 | — | — | CN | disclosed |