Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.44 |
| ▸ | CCR2 | P41597 | 8/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 2/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CDC25A | P30304 | 1/20 | 0.35 |
| ▸ | CDC25C | P30307 | 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 | |
|---|---|---|---|---|
| SCHEMBL5993039 | 0.81 | AHR (0.53) | AHRCCR2MCL1TTRAKR1B1 | |
| SCHEMBL20208693 | 0.72 | AHR (0.63) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL29706029 | 0.72 | AHR (0.63) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL5992006 | 0.71 | AHR (0.49) | AHRCCR2MCL1TTRCA1 | |
| SCHEMBL26502486 | 0.68 | AHR (0.63) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL22737968 | 0.68 | AHR (0.78) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL20208783 | 0.68 | AHR (0.60) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL29706073 | 0.68 | AHR (0.60) | AHRMCL1TTRCA1CA2 | |
| SCHEMBL21191893 | 0.67 | AHR (0.59) | AHRMCL1TTRCA12CA1 | |
| SCHEMBL30409875 | 0.66 | AHR (0.81) | AHRTTRCA1CA2 |
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-1735300-A1 | THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES | CEPHALON FRANCE (FR) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005100345-A1 | THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES | CEPHALON FRANCE (FR) | 2005-10-27 | — | — | WO | disclosed |