Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 2/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | ABAT | P80404 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18769305 | 0.85 | TAAR1 (0.46) | TAAR1LOXL2HTR2AKDM4EIDO1 | |
| SCHEMBL31737691 | 0.83 | TAAR1 (0.44) | TAAR1LOXL2HTR2AKDM4EALDH1A1 | |
| SCHEMBL3125044 | 0.83 | TAAR1 (0.45) | TAAR1LOXL2HTR2AKDM4EALDH1A1 | |
| SCHEMBL28852174 | 0.75 | TDP1 (0.45) | LOXL2ALDH1A1GAAMAPT | |
| SCHEMBL3937795 | 0.74 | ALDH1A1 (0.60) | TAAR1LOXL2HTR2AKDM4EALDH1A1 | |
| SCHEMBL18244317 | 0.73 | TAAR1 (0.33) | TAAR1IDO1 | |
| SCHEMBL15533957 | 0.71 | TTR (0.41) | HTR2A | |
| SCHEMBL11766142 | 0.71 | GABRA1 (0.42) | TAAR1IDO1ENPP2 | |
| SCHEMBL18378307 | 0.71 | TAAR1 (0.32) | TAAR1IDO1 | |
| SCHEMBL13019655 | 0.71 | GABRA1 (0.36) | TAAR1IDO1 |
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-114956933-A | Marker containing isotope oxygen atom and preparation method and application thereof | 清华大学 | 2022-08-30 | — | — | CN | disclosed |