Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.42 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.41 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12663367 | 0.86 | CYP1A2 (0.45) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL5666578 | 0.83 | KCNA5 (0.44) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL5664615 | 0.79 | KCNA5 (0.46) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL18248588 | 0.73 | CYP2C19 (0.45) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL5663585 | 0.73 | KCNA5 (0.51) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL18248622 | 0.73 | CYP2C19 (0.45) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL6196919 | 0.73 | ALDH1A1 (0.51) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL2680153 | 0.73 | ALDH1A1 (0.55) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL28193434 | 0.72 | ALDH1A1 (0.49) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 | |
| SCHEMBL12663376 | 0.72 | TSHR (0.41) | CYP2C19KCNA5KCNH2CYP2D6KCNE1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140142250-A1 | SUPRAMOLECULAR STRUCTURE HAVING SUB-NANO SCALE ORDERING | GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2014-05-22 | — | — | US | disclosed |