Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.56 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.56 |
| ▸ | ACHE | P22303 | 3/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9057752 | 0.99 | OPRM1 (0.57) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| Hydrochloric Acid SCHEMBL9024089 | 0.87 | OPRM1 (0.56) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| Hydrochloric Acid SCHEMBL8480640 | 0.84 | OPRM1 (0.52) | OPRM1CHRM2CHRM3SIGMAR1DRD2 | |
| Hydrochloric Acid SCHEMBL8486085 | 0.84 | LTA4H (0.58) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| SCHEMBL9653759 | 0.81 | OPRM1 (0.65) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| SCHEMBL14839622 | 0.79 | OPRM1 (0.55) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| SCHEMBL9030647 | 0.78 | SIGMAR1 (0.67) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| SCHEMBL9653783 | 0.77 | OPRM1 (0.57) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| Hydrochloric Acid SCHEMBL8480247 | 0.77 | SIGMAR1 (0.53) | OPRM1CHRM2CHRM3ACHESIGMAR1 | |
| SCHEMBL9471497 | 0.77 | SIGMAR1 (0.62) | OPRM1CHRM2CHRM3ACHESIGMAR1 |
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-0799202-A1 | PIPERAZINE DERIVATIVES, MEDICAMENTS CONTAINING THE SAME, THEIR USE AND PROCESS FOR PREPARING THE SAME | Dr. Karl Thomae GmbH (DE) | 1997-10-08 | — | — | EP | disclosed |