Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CTSV | O60911 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 5/20 | 0.40 |
| ▸ | FAAH | O00519 | 3/20 | 0.35 |
| ▸ | DRD3 | P35462 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8717416 | 0.99 | THRB (0.46) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8711699 | 0.79 | HPGD (0.38) | HTTKIF11KDM4EMAPTMEN1 | |
| Hydrochloric Acid SCHEMBL8714405 | 0.78 | HPGD (0.37) | HTTKIF11KDM4EMAPTMEN1 | |
| SCHEMBL8715349 | 0.77 | THRB (0.53) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8899661 | 0.76 | THRB (0.61) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8899653 | 0.76 | THRB (0.61) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8714061 | 0.76 | THRB (0.53) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8716933 | 0.76 | THRB (0.63) | THRBHTTCTSVCTSLKIF11 | |
| SCHEMBL8711865 | 0.76 | PSEN1 (0.39) | MAPTMEN1ALDH1A1KMT2AATM | |
| SCHEMBL8711929 | 0.76 | PSEN1 (0.37) | THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-5830902-A | SQUALENE SYNTHASE INHIBITOR | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1998-11-03 | — | — | US | claimed |
| US-5830902-A | SQUALENE SYNTHASE INHIBITOR | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1998-11-03 | — | — | US | disclosed |