Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | DRD4 | P21917 | 3/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HTR1B | P28222 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL27510623 | 0.90 | OPRM1 (0.51) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8298272 | 0.90 | HTR1A (0.56) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8299404 | 0.89 | HTR1A (0.57) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8303894 | 0.89 | HTR1A (0.57) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8298214 | 0.87 | HTR1A (0.54) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8433930 | 0.83 | HTR1A (0.46) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8304236 | 0.83 | HTR1A (0.53) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8297779 | 0.81 | HTR1A (0.75) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL27532215 | 0.78 | DRD2 (0.52) | HTR1ADRD4ADRA1DADRA1AADRA1B | |
| SCHEMBL8297150 | 0.78 | HTR1A (0.71) | HTR1ADRD4ADRA1DADRA1AADRA1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1223650-A | Piperidines and pyrrolidines | MERCK PATENT GMBH (DE) | 1999-07-21 | — | — | CN | disclosed |
| 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 |