Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 8/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 5/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22587392 | 0.87 | ALDH1A1 (0.66) | HTTALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL18256223 | 0.82 | HDAC3 (0.52) | HTTSMN1; SMN2HDAC3HDAC1HDAC2 | |
| SCHEMBL7522106 | 0.81 | GAA (0.67) | HDAC3HDAC1HDAC2HDAC10GAA | |
| SCHEMBL21442792 | 0.81 | HDAC3 (0.46) | HTTSMN1; SMN2HDAC3HDAC1HDAC2 | |
| SCHEMBL3235344 | 0.80 | HDAC1 (0.76) | ALDH1A1HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL15551319 | 0.78 | HDAC2 (0.51) | HTTALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL11418044 | 0.77 | HDAC3 (0.72) | HDAC3HDAC1HDAC2HDAC10HDAC4 | |
| SCHEMBL18256280 | 0.77 | RAB9A (0.53) | HTTALDH1A1SMN1; SMN2GAAKMT2A | |
| Dodecanoate SCHEMBL7192364 | 0.76 | GAA (0.62) | HDAC3HDAC1HDAC2HDAC10GAA | |
| SCHEMBL30832967 | 0.76 | HDAC1 (0.60) | ALDH1A1SMN1; SMN2HDAC3HDAC1HDAC2 |
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-2016187028-A1 | HETEROARYL COMPOUNDS, SYNTHESIS THEREOF, AND INTERMEDIATES THERETO | CELGENE AVILOMICS RESEARCH, INC. (US) | 2016-11-24 | — | — | WO | disclosed |