Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8768493 | 1.00 | SIGMAR1 (0.41) | SIGMAR1ALDH1A1HTTSLC6A2SLC6A4 | |
| SCHEMBL8767290 | 0.98 | ALDH1A1 (0.39) | SIGMAR1ALDH1A1HTTSLC6A2SLC6A4 | |
| SCHEMBL8767285 | 0.98 | ALDH1A1 (0.39) | SIGMAR1ALDH1A1HTTSLC6A2SLC6A4 | |
| SCHEMBL16191333 | 0.90 | ALDH1A1 (0.46) | ALDH1A1HTTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8961451 | 0.88 | CYP3A4 (0.43) | SLC6A2SLC6A4SLC6A3GAANPC1 | |
| SCHEMBL8154432 | 0.88 | CYP3A4 (0.43) | SLC6A2SLC6A4SLC6A3GAANPC1 | |
| SCHEMBL8159218 | 0.88 | CYP3A4 (0.43) | SLC6A2SLC6A4SLC6A3GAANPC1 | |
| SCHEMBL10479835 | 0.87 | CYP3A4 (0.42) | SLC6A2SLC6A4SLC6A3GAANPC1 | |
| SCHEMBL10479837 | 0.87 | CYP3A4 (0.42) | SLC6A2SLC6A4SLC6A3GAANPC1 | |
| SCHEMBL10479528 | 0.87 | CYP3A4 (0.42) | SLC6A2SLC6A4SLC6A3GAANPC1 |
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-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |