Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7784609 | 0.96 | HRH3 (0.33) | MMP2MMP9MMP8MMP13 | |
| SCHEMBL10341138 | 0.92 | KCNH2 (0.34) | KCNH2 | |
| SCHEMBL10359492 | 0.88 | HRH3 (0.36) | KCNH2 | |
| SCHEMBL8982419 | 0.87 | HRH3 (0.36) | KCNH2 | |
| SCHEMBL5344086 | 0.83 | HRH3 (0.34) | KCNH2 | |
| SCHEMBL10337698 | 0.79 | CHRM3 (0.32) | KCNH2 | |
| SCHEMBL10337739 | 0.79 | CHRM3 (0.32) | KCNH2 | |
| SCHEMBL10337647 | 0.79 | CHRM3 (0.32) | KCNH2 | |
| SCHEMBL10337760 | 0.79 | CHRM3 (0.32) | KCNH2 | |
| SCHEMBL10337530 | 0.79 | CHRM3 (0.32) | KCNH2 |
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 |