Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 2/20 | 0.46 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.46 |
| ▸ | FASN | P49327 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.37 |
| ▸ | QPCT | Q16769 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | CTSC | P53634 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.35 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28635699 | 0.93 | FASN (0.40) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL16211339 | 0.90 | TNKS (0.46) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL22218671 | 0.89 | TNKS (0.45) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL22218669 | 0.89 | TNKS (0.45) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL20236846 | 0.86 | FASN (0.42) | TNKSTNKS2FASNPIK3CAQPCT | |
| SCHEMBL28637466 | 0.83 | PTGES (0.43) | NR1H4CHKAARRAB9A | |
| SCHEMBL16211835 | 0.83 | HDAC1 (0.48) | TNKSTNKS2FASNPIK3CARAB9A | |
| SCHEMBL22218172 | 0.82 | TNKS (0.40) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL22218170 | 0.82 | TNKS (0.40) | TNKSTNKS2FASNPIK3CANR1H4 | |
| SCHEMBL28632493 | 0.81 | TNKS (0.43) | TNKSTNKS2FASNQPCTPDE1C |
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 |