Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.54 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.54 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25525382 | 0.93 | MTNR1A (0.58) | PTGDR2MTNR1AMTNR1BKMT2ACHRM2 | |
| SCHEMBL25710919 | 0.88 | PTGDR2 (0.55) | PTGDR2MTNR1AMTNR1BKMT2ACHRM2 | |
| SCHEMBL8400465 | 0.82 | MTNR1A (0.52) | MTNR1AMTNR1BKMT2A | |
| SCHEMBL24097456 | 0.82 | MTNR1B (0.52) | PTGDR2MTNR1AMTNR1BKMT2APTGES | |
| SCHEMBL24097453 | 0.81 | MTNR1B (0.51) | PTGDR2MTNR1AMTNR1BKMT2APTGES | |
| SCHEMBL27791910 | 0.78 | HDAC2 (0.70) | PTGDR2MTNR1AMTNR1BCHRM2CHRM1 | |
| SCHEMBL27876348 | 0.77 | ALDH1A1 (0.54) | PTGDR2MTNR1AMTNR1BCHRM2CHRM1 | |
| SCHEMBL935176 | 0.76 | PTGDR2 (0.61) | PTGDR2MTNR1AMTNR1BBCHEACHE | |
| SCHEMBL24097461 | 0.76 | PTGDR2 (0.45) | PTGDR2MTNR1AMTNR1BKMT2ACHRM2 | |
| SCHEMBL63100 | 0.76 | HDAC1 (0.61) | MTNR1AMTNR1BCHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023083895-A1 | HYDROPHILIC AZADIBENZOCYCLOOCTYNE DERIVATIVES AND METAL-FREE CLICK REACTIONS WITH THESE HYDROPHILIC AZADIBENZOCYCLOOCTYNE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2023-05-19 | — | — | WO | disclosed |