Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 12/20 | 0.43 |
| ▸ | ACHE | P22303 | 12/20 | 0.43 |
| ▸ | BACE1 | P56817 | 11/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | SCN4A | P35499 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002589 | 0.91 | BCHE (0.43) | BCHEACHEBACE1SCN4A | |
| SCHEMBL20002582 | 0.83 | ACHE (0.56) | BCHEACHEBACE1 | |
| SCHEMBL20002873 | 0.83 | ACHE (0.56) | BCHEACHEBACE1 | |
| SCHEMBL22642807 | 0.72 | DRD2 (0.58) | BCHEACHEKDM4EGAA | |
| SCHEMBL2729881 | 0.71 | DRD4 (0.48) | KDM4E | |
| SCHEMBL20002767 | 0.69 | RORC (0.43) | — | |
| SCHEMBL27573483 | 0.67 | LTA4H (0.51) | BCHEACHEBACE1CHRM2 | |
| SCHEMBL5372336 | 0.67 | LTA4H (0.51) | BCHEACHEBACE1CHRM2 | |
| Hydrochloric Acid SCHEMBL2882988 | 0.67 | FUCA1 (0.48) | BCHEACHEBACE1 | |
| SCHEMBL8553491 | 0.66 | ACHE (0.57) | BCHEACHEBACE1KDM4EGAA |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |