Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | HMGCR | P04035 | 1/20 | 0.41 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL918362 | 0.79 | HMGCR (0.44) | CYP3A4PPARGPPARAALOX5HMGCR | |
| SCHEMBL918847 | 0.79 | PTGS2 (0.59) | CYP3A4HMGCRALDH1A1PDE3BPDE3A | |
| SCHEMBL28708164 | 0.77 | ALOX5 (0.56) | CYP1A2CYP3A4CYP2C9CYP2B6ALOX5 | |
| SCHEMBL7046945 | 0.77 | PTGS2 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL919348 | 0.77 | PTGS2 (0.42) | CYP3A4HMGCRALDH1A1TSHRPDE3B | |
| SCHEMBL6931161 | 0.76 | PDE3B (0.41) | CYP3A4PPARGPPARAHMGCRALDH1A1 | |
| SCHEMBL918757 | 0.76 | PGK1 (0.46) | CYP3A4PPARGPPARAHMGCRALDH1A1 | |
| SCHEMBL918581 | 0.75 | L3MBTL1 (0.48) | CYP1A2CYP3A4CYP2C9CYP2C19PPARG | |
| SCHEMBL7114104 | 0.75 | ALOX5 (0.53) | CYP3A4ALOX5HMGCRTDP1PDE3B | |
| Hydrochloric Acid SCHEMBL25186690 | 0.73 | HTR2A (0.61) | CYP1A2CYP3A4ALDH1A1TSHRNFKB1 |
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-1368306-A1 | NOVEL 1,2-DIPHENYLETHENE DERIVATIVES FOR TREATMENT OF IMMUNE DISEASES | Welichem Biotech Inc. (CA) | 2003-12-10 | — | — | EP | disclosed |
| WO-2002057219-A1 | NOVEL 1,2-DIPHENYLETHENE DERIVATIVES FOR TREATMENT OF IMMUNE DISEASES | WELICHEM BIOTECH INC. (CA) | 2002-07-25 | — | — | WO | disclosed |