Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3548653 | 0.88 | OPRM1 (0.47) | OPRM1SIGMAR1CHRM2CHRM3ACHE | |
| SCHEMBL3548654 | 0.88 | OPRM1 (0.47) | OPRM1SIGMAR1CHRM2CHRM3ACHE | |
| SCHEMBL3548657 | 0.88 | OPRM1 (0.47) | OPRM1SIGMAR1CHRM2CHRM3ACHE | |
| SCHEMBL3524495 | 0.84 | ACHE (0.53) | OPRM1CHRM2CHRM3ACHEBCHE | |
| SCHEMBL4397749 | 0.84 | ACHE (0.53) | OPRM1CHRM2CHRM3ACHEBCHE | |
| SCHEMBL691150 | 0.77 | ACHE (0.57) | SIGMAR1ACHEBCHEALDH1A1 | |
| SCHEMBL6078747 | 0.77 | ACHE (0.57) | SIGMAR1ACHEBCHEALDH1A1 | |
| SCHEMBL1373575 | 0.77 | ACHE (0.57) | SIGMAR1ACHEBCHEALDH1A1 | |
| SCHEMBL8844605 | 0.77 | OPRM1 (0.50) | OPRM1CHRM2CHRM3ALDH1A1KDM4E | |
| SCHEMBL3686563 | 0.77 | DRD4 (0.55) | — |
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-2338888-A1 | Imidazopyridine derivatives as JAK inhibitors | Almirall, S.A. (ES) | 2011-06-29 | — | — | EP | disclosed |