Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | MME | P08473 | 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 | |
|---|---|---|---|---|
| SCHEMBL4539487 | 0.90 | CYP1A2 (0.46) | CYP1A2CYP2C19PTGS1CYP4F2CYP4A11 | |
| SCHEMBL277802 | 0.89 | CYP1A2 (0.40) | CYP1A2CYP2C19BBOX1PTGS1ALDH1A1 | |
| Ethylene Glycol SCHEMBL7148634 | 0.85 | CYP1A2 (0.37) | CYP1A2BBOX1PTGS1 | |
| SCHEMBL2159793 | 0.82 | LMNA (0.37) | CYP1A2ALDH1A1 | |
| SCHEMBL27313919 | 0.80 | CYP1A2 (0.45) | CYP1A2CYP2C19CYP4F2CYP4A11TBXAS1 | |
| SCHEMBL220706 | 0.80 | CYP2C19 (0.54) | CYP1A2CYP2C19BBOX1CYP4F2CYP4A11 | |
| SCHEMBL11770353 | 0.80 | CYP2C19 (0.61) | CYP1A2CYP2C19ALDH1A1MME | |
| SCHEMBL11773361 | 0.80 | CYP2C19 (0.61) | CYP1A2CYP2C19ALDH1A1MME | |
| SCHEMBL15106900 | 0.79 | CYP1A2 (0.35) | CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL220603 | 0.78 | CYP2C19 (0.57) | CYP1A2CYP2C19CYP4F2CYP4A11ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100015452-A1 | COMPOSITE ARTICLE PROVIDING BLAST MITIGATION AND METHOD FOR MANUFACTURING SAME | PPG INDUSTRIES OHIO, INC. | 2010-01-21 | — | — | US | disclosed |
| EP-0164523-B1 | TIRES AND WHEELS FROM LOW HEAT BUILDUP POLYURETHANE COMPOSITIONS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-09-04 | — | — | EP | disclosed |
| US-4786703-A | FREE OF OLIGOMERS AND UNREACTED DIISOCYANATE | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1988-11-22 | — | — | US | disclosed |
| EP-0164523-A1 | Tires and wheels from low heat buildup polyurethane compositions | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1985-12-18 | — | — | EP | disclosed |
| US-4556703-A | Low heat buildup polyurethane compositions and articles | AMERICAN CYANAMID COMPANY (US) | 1985-12-03 | — | — | US | disclosed |