Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | USP5 | P45974 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709459 | 0.91 | CXCR3 (0.34) | SLC6A2SLC6A4NPC1RAB9APKM | |
| SCHEMBL1709358 | 0.91 | DPEP1 (0.36) | DGAT1SLC6A2SLC6A4NPC1RAB9A | |
| SCHEMBL1709454 | 0.89 | SLC6A2 (0.40) | SLC6A2SLC6A4CYP3A4PKM | |
| SCHEMBL1709409 | 0.88 | POLB (0.38) | DGAT1SLC6A2SLC6A4RAB9ASMN1; SMN2 | |
| SCHEMBL10033134 | 0.88 | USP30 (0.36) | USP30DGAT1SOAT1HDAC6HDAC3 | |
| SCHEMBL1709408 | 0.86 | DGAT1 (0.38) | DGAT1CYP3A4 | |
| SCHEMBL1709489 | 0.86 | OPRM1 (0.37) | DGAT1SLC6A2SLC6A4PTGDR2PKM | |
| SCHEMBL1709480 | 0.85 | NPC1 (0.38) | DGAT1NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL1709407 | 0.84 | TP53 (0.39) | HDAC6HDAC1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1709481 | 0.84 | MDM2 (0.43) | SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |