Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL16430586 | 0.82 | CHRNB2 (0.39) | AOC3PIK3CDPIK3CAPIK3CBPI4KA | |
| SCHEMBL13527768 | 0.75 | LOXL2 (0.32) | AOC3 | |
| SCHEMBL19782115 | 0.74 | KDM4E (0.34) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL13771999 | 0.73 | AOC3 (0.35) | AOC3 | |
| SCHEMBL31461876 | 0.72 | CHRNB2 (0.37) | AOC3PIK3CDPIK3CAPIK3CBPI4KA | |
| SCHEMBL7935594 | 0.72 | CHRNB2 (0.37) | AOC3PIK3CDPIK3CAPIK3CBPI4KA | |
| SCHEMBL12248364 | 0.72 | CHRNB2 (0.32) | PIK3CDPIK3CAPIK3CBPI4KAPIK3CG | |
| SCHEMBL16983463 | 0.72 | RAB9A (0.47) | AOC3PIK3CDPIK3CAPIK3CBPI4KA | |
| SCHEMBL16430682 | 0.71 | CHRNB2 (0.33) | AOC3PIK3CDPIK3CAPIK3CBPI4KA | |
| SCHEMBL18647489 | 0.71 | AOC3 (0.39) | AOC3RAB9AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3418280-B1 | COMPOUNDS AS MODULATORS OF ROR GAMMA | BOEHRINGER INGELHEIM INT (DE) | 2023-07-12 | — | — | EP | disclosed |