Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAT2A | P31153 | 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 | |
|---|---|---|---|---|
| SCHEMBL8767312 | 0.94 | MAPT (0.41) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL8767786 | 0.94 | MAPT (0.41) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL8766989 | 0.88 | IDO1 (0.42) | IDO1ALDH1A1TSHRMDM2SLC6A4 | |
| SCHEMBL8095275 | 0.87 | CYP2C9 (0.48) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL7513854 | 0.87 | CYP2C9 (0.48) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL8095280 | 0.87 | CYP2C9 (0.48) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL9060138 | 0.85 | IDO1 (0.43) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL9060290 | 0.85 | IDO1 (0.43) | MAPTESR2IDO1ALDH1A1CYP2C9 | |
| SCHEMBL8094834 | 0.84 | IDO1 (0.46) | MAPTESR2IDO1ALDH1A1TSHR | |
| SCHEMBL8094827 | 0.84 | IDO1 (0.46) | MAPTESR2IDO1ALDH1A1TSHR |
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 |