Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.36 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 3/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25921954 | 0.83 | VKORC1 (0.38) | KMT2AVKORC1TYRMEN1NPC1 | |
| SCHEMBL29173278 | 0.75 | KMT2A (0.38) | KMT2AKDM4ESLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8953528 | 0.72 | CYP11B2 (0.36) | — | |
| Benzene SCHEMBL28192760 | 0.71 | TAAR1 (0.50) | KMT2AKDM4ETYRTAAR1ALDH1A1 | |
| SCHEMBL169730 | 0.71 | TAAR1 (0.50) | KMT2AKDM4ETYRTAAR1ALDH1A1 | |
| SCHEMBL7499823 | 0.71 | TAAR1 (0.50) | KMT2AKDM4ETYRTAAR1ALDH1A1 | |
| SCHEMBL419410 | 0.70 | VKORC1 (0.49) | KMT2AKDM4EVKORC1TYRMEN1 | |
| SCHEMBL16154382 | 0.70 | IDO1 (0.50) | KMT2ATRPV3TYRMEN1TAAR1 | |
| SCHEMBL17071857 | 0.70 | IDO1 (0.50) | KMT2ATRPV3TYRMEN1TAAR1 | |
| SCHEMBL17071859 | 0.70 | IDO1 (0.50) | KMT2ATRPV3TYRMEN1TAAR1 |
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-117702142-A | C (C) 4 Process for preparing substituted pyridine derivatives | 五邑大学 | 2024-03-15 | — | — | CN | disclosed |