Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 4/20 | 0.60 |
| ▸ | HTR1B | P28222 | 4/20 | 0.60 |
| ▸ | APP | P05067 | 3/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | HTR1F | P30939 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4670916 | 0.85 | APP (0.63) | HTR1DHTR1BAPPSLC6A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL7866348 | 0.84 | APP (0.62) | HTR1DHTR1BAPPSLC6A4CYP1A2 | |
| SCHEMBL21088266 | 0.83 | HTR1D (0.80) | HTR1DHTR1BAPPSLC6A4CYP1A2 | |
| SCHEMBL27548381 | 0.81 | HTR1B (0.69) | HTR1DHTR1BAPPSLC6A4CYP1A2 | |
| SCHEMBL27467342 | 0.77 | SLC6A4 (0.60) | HTR1DSLC6A4CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL427406 | 0.76 | HTR1D (1.00) | HTR1DHTR1BAPPCYP1A2CYP3A4 | |
| SCHEMBL4674422 | 0.76 | HTR1D (0.71) | HTR1DHTR1BAPPSLC6A4CYP1A2 | |
| SCHEMBL6796369 | 0.75 | OPRM1 (0.46) | HTR1DHTR1BAPPSLC6A4DRD2 | |
| SCHEMBL6598131 | 0.75 | SLC6A4 (0.49) | HTR1DHTR1BSLC6A4DRD2OPRM1 | |
| Hydrochloric Acid SCHEMBL7485776 | 0.75 | HTR1D (0.97) | HTR1DHTR1BAPPCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1154105-A | 4-aryl-1-(indanmethyl, dihydrobenzofuranmethyl or dihydrobenzothiophenemethyl) piperidines, tetrahydropyridines or piperazines | LUNDBECK & CO AS H (DK) | 1997-07-09 | — | — | CN | disclosed |