Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1556555 | 0.92 | EPHX2 (0.53) | EPHX2MGLLCYP2D6ALDH1A1CYP3A4 | |
| SCHEMBL19603318 | 0.87 | MGLL (0.48) | MGLLFAAH | |
| SCHEMBL23968905 | 0.85 | OPRD1 (0.51) | EPHX2MGLLCYP2D6ALDH1A1 | |
| SCHEMBL23642541 | 0.85 | OPRD1 (0.51) | EPHX2MGLLCYP2D6ALDH1A1CYP3A4 | |
| SCHEMBL18711496 | 0.83 | CYP2D6 (0.58) | EPHX2CYP2D6ALDH1A1CYP3A4USP2 | |
| SCHEMBL14891885 | 0.82 | EPHX2 (0.64) | EPHX2CYP2D6ALDH1A1CYP3A4USP2 | |
| SCHEMBL18702131 | 0.80 | EPHX2 (0.48) | EPHX2MGLLCYP2D6ALDH1A1CYP3A4 | |
| SCHEMBL19582609 | 0.79 | MGLL (0.74) | MGLL | |
| SCHEMBL30924710 | 0.79 | SIGMAR1 (0.45) | EPHX2ALDH1A1CYP3A4TSHR | |
| SCHEMBL1557924 | 0.79 | KMT2A (0.49) | EPHX2CYP2D6CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3455226-B1 | SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME | LUNDBECK LA JOLLA RESEARCH CENTER INC (US) | 2020-12-30 | — | — | EP | disclosed |
| EP-3455226-A1 | SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME | Abide Therapeutics, Inc. (US) | 2019-03-20 | — | — | EP | disclosed |
| WO-2017197192-A1 | SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME | ABIDE THERAPEUTICS, INC. (US) | 2017-11-16 | — | — | WO | disclosed |