Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 5/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Enefexine SCHEMBL499360 | 0.83 | SLC18A3 (0.55) | QDPRHTR2CTLR9TLR8TLR7 | |
| SCHEMBL11141177 | 0.82 | CYP1A2 (0.47) | CYP1A2CYP2A6SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL11141169 | 0.82 | CYP1A2 (0.47) | CYP1A2CYP2A6SLC6A4SLC6A2SLC6A3 | |
| Enefexine SCHEMBL4886231 | 0.81 | SLC18A3 (0.53) | QDPRHTR2CTLR9TLR8TLR7 | |
| SCHEMBL11138918 | 0.81 | CYP1A2 (0.46) | CYP1A2CYP2A6SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL11138912 | 0.81 | CYP1A2 (0.46) | CYP1A2CYP2A6SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL4518387 | 0.80 | HTR2C (0.62) | QDPRHTR2CTLR9TLR8TLR7 | |
| Hydrochloric Acid SCHEMBL30946017 | 0.79 | HTR2C (0.63) | QDPRHTR2CTLR9TLR8TLR7 | |
| SCHEMBL11134820 | 0.78 | CYP2C9 (0.48) | CYP1A2CYP2A6SLC6A4DRD2 | |
| SCHEMBL11134815 | 0.78 | CYP2C9 (0.48) | CYP1A2CYP2A6SLC6A4DRD2 |
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-6303627-B1 | FOR THERAPY OF PHYSIOLOGICAL AND PSYCHOLOGICAL DISORDERS | ELI LILLY AND COMPANY | 2001-10-16 | — | — | US | disclosed |
| EP-0965587-A1 | Tetrahydropyridinyl- and piperidinyl Inhibitors of serotonin reuptake | ELI LILLY AND COMPANY (US) | 1999-12-22 | — | — | EP | disclosed |