Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.56 |
| ▸ | DRD4 | P21917 | 5/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.56 |
| ▸ | HTR7 | P34969 | 4/20 | 0.56 |
| ▸ | HTR2B | P41595 | 3/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.56 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HTR1B | P28222 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8296717 | 0.94 | HTR1A (0.56) | HTR1AADRA1ADRD4ADRA1BHTR7 | |
| SCHEMBL8297500 | 0.90 | HTR1A (0.53) | HTR1AADRA1ADRD4ADRA1BHTR7 | |
| SCHEMBL8299874 | 0.89 | OPRM1 (0.50) | HTR1AHTR7HTR2AADRA1DOPRM1 | |
| SCHEMBL8304245 | 0.88 | OPRM1 (0.56) | HTR1AHTR7HTR2AADRA1DOPRM1 | |
| SCHEMBL8299533 | 0.84 | HSD11B1 (0.60) | HTR1AHTR7HTR2AOPRM1OPRK1 | |
| SCHEMBL8303699 | 0.82 | ADRA1D (0.57) | HTR1AADRA1BHTR7HTR2AADRA1D | |
| SCHEMBL8296250 | 0.82 | HSD11B1 (0.62) | HTR1AHTR7HTR2AADRA1DHTR1B | |
| SCHEMBL8303547 | 0.79 | DRD2 (0.51) | HTR1AADRA1BHTR7HTR2AADRA1D | |
| SCHEMBL8297779 | 0.78 | HTR1A (0.75) | HTR1AADRA1ADRD4ADRA1BHTR7 | |
| SCHEMBL8302784 | 0.77 | HTR7 (0.56) | HTR1AADRA1AADRA1BHTR7HTR2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0898569-A1 | PIPERIDINES AND PYRROLIDINES | MERCK PATENT GmbH (DE) | 1999-03-03 | — | — | EP | claimed |
| WO-1997040038-A1 | PIPERIDINES AND PYRROLIDINES | MERCK PATENT GMBH (DE) | 1997-10-30 | — | — | WO | claimed |
| EP-0898569-A1 | PIPERIDINES AND PYRROLIDINES | MERCK PATENT GmbH (DE) | 1999-03-03 | — | — | EP | disclosed |
| WO-1997040038-A1 | PIPERIDINES AND PYRROLIDINES | MERCK PATENT GMBH (DE) | 1997-10-30 | — | — | WO | disclosed |