Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1221514 | 0.88 | POLB (0.60) | NPC1RAB9APOLBKMT2AGAA | |
| SCHEMBL4559855 | 0.86 | POLB (0.53) | NPC1RAB9AMAPTPOLBHTT | |
| SCHEMBL14372224 | 0.84 | NPC1 (0.65) | NPC1RAB9AMAPTPOLBHTT | |
| SCHEMBL4282303 | 0.83 | POLB (0.71) | MAPTPOLBHTTGAA | |
| SCHEMBL29104584 | 0.81 | KDM4E (0.58) | NPC1RAB9AMAPTPOLBKMT2A | |
| SCHEMBL1080002 | 0.79 | MEN1 (0.65) | MAPTPOLBKMT2ATHRB | |
| SCHEMBL30576787 | 0.77 | TAAR1 (0.61) | MAPTPOLBKMT2ATHRB | |
| SCHEMBL2384053 | 0.77 | KDM4E (0.70) | NPC1RAB9APOLBKMT2AGAA | |
| SCHEMBL7760053 | 0.76 | POLB (0.50) | NPC1RAB9AMAPTPOLBCD274 | |
| SCHEMBL30576775 | 0.76 | POLB (0.60) | NPC1RAB9APOLBKMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106232584-A | As the new compound of histone deacetylase 6 inhibitor and the pharmaceutical composition comprising it | 株式会社钟根堂 | 2016-12-14 | — | — | CN | disclosed |
| EP-1695961-A1 | UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE | Takeda Pharmaceutical Company Limited (JP) | 2006-08-30 | — | — | EP | disclosed |