Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 3/20 | 0.71 |
| ▸ | HTR1B | P28222 | 1/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 3/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27732808 | 0.89 | HTR1B (0.69) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7482397 | 0.87 | HTR1D (0.68) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL399291 | 0.87 | HTR1D (0.55) | HTR1DHTR1BAPPHTR2CADRB2 | |
| SCHEMBL12127332 | 0.85 | HTR1D (0.54) | HTR1DHTR1BOPRM1OPRK1OPRL1 | |
| SCHEMBL13776966 | 0.84 | HTR1B (0.60) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL427406 | 0.83 | HTR1D (1.00) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12653695 | 0.82 | HTR1B (0.65) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13846394 | 0.82 | HTR1B (0.65) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7485776 | 0.82 | HTR1D (0.97) | HTR1DHTR1BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12253746 | 0.82 | HTR1B (0.65) | HTR1DHTR1BSLC6A4HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2915804-A1 | NOVEL AMINE DERIVATIVE OR SALT THEREOF | Toyama Chemical Co., Ltd. (JP) | 2015-09-09 | — | — | EP | disclosed |