Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 8/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19281152 | 0.81 | ACACB (0.39) | ACACBALDH1A1TSHRCYP2D6 | |
| SCHEMBL12695080 | 0.77 | EPHX2 (0.45) | EPHX2EPHX1CYP2C9ACACBHDAC3 | |
| SCHEMBL12481973 | 0.75 | HTR2C (0.37) | CYP2D6 | |
| SCHEMBL19281150 | 0.71 | ACACB (0.40) | ACACBALDH1A1 | |
| SCHEMBL12695157 | 0.70 | CYP2D6 (0.36) | EPHX2EPHX1CYP2C9ACACBACACA | |
| SCHEMBL12695139 | 0.70 | CYP2D6 (0.36) | EPHX2EPHX1CYP2C9ACACBACACA | |
| SCHEMBL12695128 | 0.70 | CYP2D6 (0.36) | EPHX2EPHX1CYP2C9ACACBACACA | |
| SCHEMBL12695125 | 0.69 | EPHX2 (0.47) | EPHX2EPHX1CYP2C9ACACBHDAC3 | |
| SCHEMBL12695141 | 0.67 | EPHX2 (0.37) | EPHX2EPHX1CYP2C9ACACBTRPM8 | |
| SCHEMBL12695165 | 0.66 | ACACB (0.40) | EPHX2EPHX1ACACBUSP2TSHR |
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-2675812-B1 | CHROMAN - SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2017-08-30 | — | — | EP | disclosed |