Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.46 |
| ▸ | PARP1 | P09874 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 4/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | CASP2 | P42575 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.41 |
| ▸ | PPOX | P50336 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RGS12 | O14924 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5074783 | 0.84 | GSK3B (0.50) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL30091416 | 0.84 | GSK3B (0.50) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL7078965 | 0.84 | GSK3B (0.50) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL4421846 | 0.81 | KDM4E (0.47) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL17474487 | 0.81 | GSK3B (0.46) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL2172658 | 0.81 | GSK3B (0.46) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL2359302 | 0.80 | GSK3B (0.42) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL671809 | 0.80 | GSK3B (0.42) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL10763239 | 0.80 | GSK3B (0.42) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL11660613 | 0.80 | PARP1 (0.58) | GSK3BPARP1KDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1398317-B1 | ALICYCLIC COMPOUND FOR OPTICAL MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2011-01-12 | — | — | EP | disclosed |
| US-7301705-B2 | Alicyclic compound for optical material | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2007-11-27 | — | — | US | disclosed |
| US-20040158031-A1 | Alicyclic compound for optical material | MITSUBISHI GAS CHEMICAL CO., INC. (JP) | 2004-08-12 | — | — | US | disclosed |
| EP-1398317-A1 | ALICYCLIC COMPOUND FOR OPTICAL MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2004-03-17 | — | — | EP | disclosed |
| WO-2003022055-A1 | PESTICIDAL COMPOSITIONS | BAYER CROPSCIENCE S.A. (FR) | 2003-03-20 | — | — | WO | disclosed |