Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ENPP1 | P22413 | 4/20 | 0.42 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | GLP1R | P43220 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23589560 | 0.79 | NQO2 (0.52) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL31558290 | 0.79 | NQO2 (0.52) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL30753418 | 0.78 | KDM4E (0.42) | KDM4ENPSR1MAPTTDP1ENPP1 | |
| SCHEMBL30753419 | 0.77 | MAPT (0.42) | KDM4EMAPTENPP1ENPP3ALDH1A1 | |
| SCHEMBL13641617 | 0.74 | MAPT (0.63) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL30753427 | 0.74 | MAPT (0.63) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL265259 | 0.73 | ALDH1A1 (0.56) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL31487872 | 0.73 | ALDH1A1 (0.56) | KDM4ENPSR1MAPTTDP1ALDH1A1 | |
| SCHEMBL7527351 | 0.73 | TDP1 (0.56) | KDM4EMAPTTDP1ALDH1A1GAA | |
| SCHEMBL20047580 | 0.72 | GAA (0.38) | KDM4EMAPTENPP1ENPP3ALDH1A1 |
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-117466826-A | Preparation method of 2, 3-fluoroalkyl quinoxaline compound | 昆明理工大学 | 2024-01-30 | — | — | CN | disclosed |