Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL5534651 | 0.99 | HTT (0.52) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| SCHEMBL5532426 | 0.80 | HTT (0.61) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| SCHEMBL5533851 | 0.75 | HTT (0.82) | HTTHSD17B10SMN1; SMN2CYP3A4ALDH1A1 | |
| SCHEMBL11686502 | 0.74 | HTT (0.71) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| Water SCHEMBL6854528 | 0.70 | PNP (0.36) | HTTSMN1; SMN2MAPTTSHRKDM4E | |
| SCHEMBL14283719 | 0.70 | HTT (0.65) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| SCHEMBL14283722 | 0.70 | HTT (0.65) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| SCHEMBL14308366 | 0.70 | HTT (0.65) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| SCHEMBL1266791 | 0.70 | HTT (1.00) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL5535871 | 0.69 | HTT (0.97) | HTTHSD17B10SMN1; SMN2CYP3A4TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1416931-B1 | INHIBITORS OF POLYQ-AGGREGATION | MAX PLANCK GESELLSCHAFT (DE) | 2007-06-13 | — | — | EP | claimed |