Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 13/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9250443 | 1.00 | SCN9A (0.35) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9250854 | 0.95 | SCN9A (0.36) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9250852 | 0.95 | SCN9A (0.36) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9250697 | 0.89 | RIPK1 (0.35) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9250703 | 0.89 | RIPK1 (0.35) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9405907 | 0.85 | FFAR1 (0.39) | HTR2AHTR2CHTR2BPDE4APDE4B | |
| SCHEMBL9405905 | 0.85 | FFAR1 (0.39) | HTR2AHTR2CHTR2BPDE4APDE4B | |
| SCHEMBL9405904 | 0.85 | FFAR1 (0.39) | HTR2AHTR2CHTR2BPDE4APDE4B | |
| SCHEMBL9251122 | 0.85 | SCN9A (0.33) | SCN9AHTR2AHTR2CHTR2BACACB | |
| SCHEMBL9251116 | 0.85 | SCN9A (0.33) | SCN9AHTR2AHTR2CHTR2BACACB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995010495-A1 | 2,3,4,5-TETRAFLUOROBENZENES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | MERCK PATENT GMBH (DE) | 1995-04-20 | — | — | WO | disclosed |