Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14048976 | 0.79 | CYP3A4 (0.43) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL703634 | 0.78 | AOC3 (0.50) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL21937942 | 0.78 | CYP2C19 (0.45) | CYP3A4CYP2D6RIPK1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7940010 | 0.77 | AOC3 (0.42) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL6666755 | 0.75 | AOC3 (0.52) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL27541288 | 0.75 | RIPK1 (0.39) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL14143990 | 0.74 | TAAR1 (0.42) | SLC6A4SLC6A2SLC6A3CYP2D6LMNA | |
| SCHEMBL25237701 | 0.74 | AOC3 (0.50) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL8930612 | 0.74 | AOC3 (0.50) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL1548351 | 0.73 | AOC3 (0.46) | SLC6A4SLC6A2SLC6A3CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110407963-B | Catalyst component for olefin polymerization and preparation method thereof | 中国石油化工股份有限公司 | 2021-09-21 | — | — | CN | disclosed |