Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7911171 | 0.96 | ALDH1A1 (0.40) | ALDH1A1TSHRHSD17B10PARP15PARP10 | |
| SCHEMBL7903600 | 0.84 | ALDH1A1 (0.43) | ALDH1A1TSHRHSD17B10CETP | |
| SCHEMBL7917364 | 0.84 | CYP2C9 (0.46) | ALDH1A1TSHRHSD17B10ACACB | |
| SCHEMBL8834213 | 0.82 | SCN9A (0.37) | PARP15PARP10ABHD6ACACBPDK2 | |
| SCHEMBL7903591 | 0.82 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10ACACB | |
| SCHEMBL7914087 | 0.81 | CYP2C9 (0.43) | ALDH1A1TSHRHSD17B10ACACB | |
| SCHEMBL7913245 | 0.81 | CYP2C9 (0.43) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL7912009 | 0.81 | CYP2C9 (0.43) | ALDH1A1TSHRHSD17B10ACACB | |
| SCHEMBL7917601 | 0.81 | ALDH1A1 (0.40) | ALDH1A1TSHRHSD17B10CETP | |
| SCHEMBL7911208 | 0.81 | CYP2C9 (0.41) | ALDH1A1TSHRHSD17B10ACACB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640578-B2 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 2001-06-27 | — | — | EP | disclosed |
| EP-0640578-B1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 1997-11-05 | — | — | EP | disclosed |
| EP-0640578-A1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | Chisso Corporation (JP) | 1995-03-01 | — | — | EP | disclosed |