Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 9/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7793322 | 0.93 | ACACB (0.47) | ACACBALDH1A1MAOBLMNAS1PR4 | |
| SCHEMBL7790257 | 0.92 | ALDH1A1 (0.50) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7790483 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7794137 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7790497 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7794165 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7794619 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7794158 | 0.90 | ALDH1A1 (0.52) | ACACBALDH1A1LMNAS1PR4S1PR1 | |
| SCHEMBL7790523 | 0.88 | CYP2D6 (0.46) | ALDH1A1MAOBLMNAL3MBTL1S1PR4 | |
| SCHEMBL7794081 | 0.88 | CYP2D6 (0.46) | ALDH1A1MAOBLMNAL3MBTL1S1PR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1150937-A1 | LIQUID CRYSTALLINE TRIFLUORO-SUBSTITUTED COMPOUNDS | QinetiQ Limited (GB) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000039062-A1 | LIQUID CRYSTALLINE TRIFLUORO-SUBSTITUTED COMPOUNDS | THE SECRETARY OF STATE FOR DEFENCE (GB) | 2000-07-06 | — | — | WO | disclosed |