Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.47 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.40 |
| ▸ | NQO2 | P16083 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10407585 | 0.92 | HTR1A (0.54) | HTR1AENPP2SIGMAR1HTR2BHTR7 | |
| SCHEMBL9014335 | 0.80 | KDM4E (0.37) | HTR1AMTNR1AMTNR1B | |
| SCHEMBL9234439 | 0.80 | DRD3 (0.37) | HTR1ADRD2DRD3 | |
| SCHEMBL9014788 | 0.80 | ADRA2A (0.40) | HTR1AMTNR1AMTNR1BDRD2DRD3 | |
| SCHEMBL5479142 | 0.78 | HTR1A (0.54) | HTR1AENPP2SIGMAR1HTR2BHTR7 | |
| SCHEMBL9014733 | 0.76 | DRD2 (0.39) | DRD2DRD3 | |
| SCHEMBL9014727 | 0.76 | KCNH2 (0.38) | MTNR1AMTNR1B | |
| SCHEMBL9014779 | 0.73 | KCNH2 (0.70) | ENPP2SIGMAR1DRD2 | |
| SCHEMBL7950300 | 0.73 | MTNR1A (0.62) | MTNR1AMTNR1BNQO2 | |
| SCHEMBL24915792 | 0.73 | ENPP2 (0.48) | HTR1AENPP2SIGMAR1HTR2BHTR7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5495022-A | Piperidines and piperazines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-02-27 | — | — | US | disclosed |
| EP-0634398-A1 | 4-Phenylpiperidinyl-1/-piperazinyl-1-ethylsubstituted benzofusedheterocycles as antiarrhythmic agents | MERCK PATENT GmbH (DE) | 1995-01-18 | — | — | EP | disclosed |