Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9495194 | 0.83 | ALDH1A1 (0.56) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL15656392 | 0.81 | ADRA2A (0.40) | ALDH1A1TRPA1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL9482716 | 0.81 | ALDH1A1 (0.54) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL15658398 | 0.80 | ESR1 (0.48) | CYP3A4CYP2C9CYP2C19LMNAGAA | |
| SCHEMBL5596296 | 0.79 | GABRA1 (0.38) | HPGDCYP3A4CYP1A2CYP2C9KMT2A | |
| SCHEMBL5595989 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL921042 | 0.76 | ALDH1A1 (0.59) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL99348 | 0.76 | GABRA1 (0.73) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL9193972 | 0.76 | ALDH1A1 (0.59) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 | |
| SCHEMBL30345339 | 0.76 | GABRA1 (0.73) | ALDH1A1TRPA1HPGDCYP3A4CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7279537-B2 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-10-09 | — | — | US | disclosed |
| US-20060229195-A1 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-10-12 | — | — | US | disclosed |
| EP-1557423-A1 | TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS | Sumitomo Chemical Company, Limited (JP) | 2005-07-27 | — | — | EP | disclosed |