Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RHEB | Q15382 | 5/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR1D | P28221 | 2/20 | 0.47 |
| ▸ | HTR1B | P28222 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | MPO | P05164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL1399365 | 0.84 | HTR2A (0.61) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL30776660 | 0.81 | HTR2A (0.59) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL2239944 | 0.81 | HTR2A (0.59) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL28872529 | 0.80 | RHEB (0.76) | RHEBHTR6GFERAHRPIK3CD | |
| SCHEMBL2153441 | 0.79 | TAAR1 (0.54) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL1399336 | 0.78 | IFNAR1 (0.62) | RHEBCYP1A2CYP3A4CYP2D6SLC6A2 | |
| Hydrochloric Acid SCHEMBL4447997 | 0.77 | TAAR1 (0.52) | TAAR1HTR2ACYP2A6PMP22SLC6A2 | |
| SCHEMBL1399317 | 0.77 | TAAR1 (0.39) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL4963437 | 0.75 | GFER (0.57) | TAAR1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL1399472 | 0.74 | NPC1 (0.40) | RHEBTAAR1HTR2AHTR1DHTR1B |
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-1860100-B1 | 2-(1H-indolylsulfanyl)-benzyl amine derivatives as SSRI | LUNDBECK & CO AS H (DK) | 2011-03-02 | — | — | EP | claimed |