Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1535623 | 0.91 | GAA (0.46) | GAAHTTCHRM2CHRM4CHRM1 | |
| SCHEMBL7508350 | 0.91 | GAA (0.46) | GAAHTTCHRM2CHRM4CHRM1 | |
| Ot-551 SCHEMBL3692374 | 0.91 | GAA (0.46) | GAAHTTCHRM2CHRM4CHRM1 | |
| Ot-551 SCHEMBL3696276 | 0.90 | GAA (0.48) | GAAHTTLMNAALDH1A1KMT2A | |
| SCHEMBL19636872 | 0.85 | GAA (0.42) | GAAHTTLMNAALDH1A1KMT2A | |
| SCHEMBL19976794 | 0.85 | HTT (0.42) | GAAHTTCHRM2CHRM4CHRM1 | |
| SCHEMBL5181469 | 0.85 | GAA (0.43) | GAAHTTCHRM2CHRM4CHRM1 | |
| SCHEMBL21163573 | 0.84 | GAA (0.46) | GAAHTTLMNAALDH1A1KMT2A | |
| SCHEMBL19884611 | 0.84 | GAA (0.41) | GAAHTTKMT2ATSHRL3MBTL1 | |
| SCHEMBL13554257 | 0.83 | GAA (0.40) | GAAHTTALDH1A1KMT2ATSHR |
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-2017198637-A1 | LIQUID-CRYSTAL MATERIAL | MERCK PATENT GMBH (DE) | 2017-11-23 | — | — | WO | disclosed |