Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 4/20 | 0.55 |
| ▸ | CFTR | P13569 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | F2RL1 | P55085 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5588306 | 0.89 | AHR (0.50) | AHRCFTRALDH1A1F2RL1CYP1A1 | |
| SCHEMBL5587386 | 0.80 | AHR (0.47) | AHRCFTRALDH1A1CYP1A1 | |
| SCHEMBL6252702 | 0.80 | ALDH1A1 (0.39) | AHRALDH1A1CYP1A1 | |
| SCHEMBL5588673 | 0.79 | AHR (0.53) | AHRCFTRAKR1B1 | |
| Ethane SCHEMBL28414050 | 0.78 | AHR (0.78) | AHRALDH1A1 | |
| SCHEMBL9579668 | 0.78 | — | — | |
| SCHEMBL6256853 | 0.75 | AHR (0.57) | AHRALDH1A1CYP1A1 | |
| SCHEMBL6254624 | 0.73 | AHR (0.64) | AHRALDH1A1 | |
| SCHEMBL2438856 | 0.73 | AHR (0.41) | AHRALDH1A1F2RL1 | |
| SCHEMBL3172291 | 0.72 | AHR (0.69) | AHR |
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-1521758-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | Exxonmobil Chemical Patents Inc. (US) | 2005-04-13 | — | — | EP | disclosed |
| WO-2004007509-A1 | LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-01-22 | — | — | WO | disclosed |