Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| Butadiene SCHEMBL9678114 | 0.88 | AKR1C3 (0.52) | AKR1C3GAAGLATDP1GRIK1 | |
| SCHEMBL28058200 | 0.86 | AKR1C3 (0.58) | AKR1C3GLATDP1CYP2C19PSMD14 | |
| SCHEMBL22227619 | 0.84 | FOS (0.47) | PTGS1AKR1C3GAAALDH1A1LMNA | |
| SCHEMBL481831 | 0.84 | APP (0.52) | PTGS1AKR1C3GAAALDH1A1LMNA | |
| SCHEMBL16462 | 0.83 | AKR1C3 (0.59) | AKR1C3GAAGLATDP1GRIK1 | |
| SCHEMBL693055 | 0.83 | AKR1C3 (0.59) | AKR1C3GAAGLATDP1GRIK1 | |
| SCHEMBL10454886 | 0.83 | AKR1C3 (0.59) | AKR1C3GAAGLATDP1GRIK1 | |
| Styrene SCHEMBL451196 | 0.83 | AKR1C3 (0.50) | AKR1C3GAAGLATDP1GRIK1 | |
| Acrylic Acid SCHEMBL448096 | 0.83 | AKR1C3 (0.50) | AKR1C3GAAGLATDP1GRIK1 | |
| SCHEMBL27989518 | 0.83 | PTGS1 (0.42) | PTGS1AKR1C3GAAGLATDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2031000-B1 | Preparation method for a thermosetting polymer / thermoplastic polymer alloy type transparent material and its application in optics for the production of organic glasses | ESSILOR INT (FR) | 2009-11-25 | — | — | EP | disclosed |
| EP-2031000-A1 | Preparation method for a thermosetting polymer / thermoplastic polymer alloy type transparent material and its application in optics for the production of organic glasses | Essilor International (Compagnie Générale D'Optique) (FR) | 2009-03-04 | — | — | EP | disclosed |
| EP-1877839-B1 | THERMOSETTING POLY(THIO)URETHANE FORMULATION COMPRISING AT LEAST ONE BLOCK COPOLYMER AND USE THEREOF IN OPTICS FOR THE PRODUCTION OF ORGANIC LENSES HAVING IMPROVED TOUGHNESS | ESSILOR INT (FR) | 2008-12-03 | — | — | EP | disclosed |