Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 6/20 | 0.45 |
| ▸ | KDM1B | Q8NB78 | 4/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL10456466 | 1.00 | KDM1A (0.45) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL850836 | 0.89 | KDM1A (0.50) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL30711810 | 0.86 | KDM1A (0.52) | KDM1AKDM1BKCNH2RAPGEF4ALDH1A1 | |
| SCHEMBL833057 | 0.86 | KDM1A (0.52) | KDM1AKDM1BKCNH2RAPGEF4ALDH1A1 | |
| SCHEMBL1224640 | 0.86 | KDM1A (0.38) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL29478809 | 0.86 | KDM1A (0.38) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL3565431 | 0.83 | KDM1A (0.41) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL1478306 | 0.83 | KDM1A (0.45) | KDM1AKDM1BKCNH2RAPGEF4ALDH1A1 | |
| SCHEMBL30578349 | 0.83 | KDM1A (0.41) | KDM1AKDM1BKCNH2BCHECES1 | |
| SCHEMBL30228644 | 0.83 | KDM1A (0.45) | KDM1AKDM1BKCNH2RAPGEF4ALDH1A1 |
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-112573990-B | Preparation method of 4-halogenated-3-fluorotoluene | 沈阳中化农药化工研发有限公司 | 2022-05-06 | — | — | CN | disclosed |