Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17583583 | 0.84 | UGT2B7 (0.53) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL5595457 | 0.83 | LMNA (0.61) | CYP2D6CYP3A4MEN1KMT2ATSHR | |
| SCHEMBL30076171 | 0.82 | UGT2B7 (0.55) | UGT2B7MMP9CYP1A2TSHR | |
| SCHEMBL4808086 | 0.82 | UGT2B7 (0.55) | UGT2B7MMP9CYP1A2TSHR | |
| SCHEMBL28555283 | 0.80 | CES2 (0.63) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL17585039 | 0.78 | TDP1 (0.62) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL1900888 | 0.78 | UGT2B7 (0.63) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL3151796 | 0.77 | UGT2B7 (0.73) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL9657913 | 0.76 | L3MBTL1 (0.69) | UGT2B7SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL15834920 | 0.75 | LMNA (0.55) | KCNH2CYP3A4KMT2ATSHRATM |
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-1203616-B1 | CHIRAL LEAD CATALYST AND METHOD OF ASYMMETRIC ALDOL REACTION | JAPAN SCIENCE & TECH AGENCY (JP) | 2007-01-10 | — | — | EP | disclosed |
| US-6780812-B2 | SUCH AS LEAD TRIFLATE AND A CHIRAL CROWN ETHER COMPOUND | JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) | 2004-08-24 | — | — | US | disclosed |
| EP-1203616-A1 | CHIRAL LEAD CATALYST AND METHOD OF ASYMMETRIC ALDOL REACTION | Japan Science and Technology Corporation (JP) | 2002-05-08 | — | — | EP | disclosed |