Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.56 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | RXFP3 | Q9NSD7 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 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 | |
|---|---|---|---|---|
| SCHEMBL1399292 | 0.89 | IDO1 (0.47) | HTR2ATRPM8GPR84HTR2CMPO | |
| SCHEMBL1399252 | 0.87 | IDO1 (0.48) | HTR2ATRPM8GPR84HTR2CMPO | |
| SCHEMBL1399203 | 0.85 | GPR84 (0.45) | HTR2AFFAR1GPR84HTR2CHTR2B | |
| SCHEMBL1399305 | 0.84 | HTR2A (0.59) | HTR2ATRPM8HTR2CHTR6IDO1 | |
| SCHEMBL1399250 | 0.84 | HTR2A (0.62) | HTR2ATRPM8FFAR1GPR84HTR2C | |
| SCHEMBL1399442 | 0.81 | HTR2A (0.55) | HTR2ATRPM8HTR2CMPOCYP1A2 | |
| SCHEMBL1399427 | 0.81 | HTR2A (0.59) | HTR2ATRPM8FFAR1GPR84HTR2C | |
| SCHEMBL1399386 | 0.81 | MPO (0.56) | HTR2ATRPM8GPR84RXFP3MPO | |
| SCHEMBL1399423 | 0.80 | HTR2A (0.57) | HTR2ATRPM8FFAR1GPR84HTR2C | |
| SCHEMBL4633964 | 0.79 | HTR2A (0.54) | HTR2ATRPM8GPR84HTR2CMPO |
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 |
|---|---|---|---|---|---|---|---|
| EP-1860100-B1 | 2-(1H-indolylsulfanyl)-benzyl amine derivatives as SSRI | LUNDBECK & CO AS H (DK) | 2011-03-02 | — | — | EP | claimed |
| US-7652150-B2 | 2-(1H-indolylsulfanyl)-benzyl amine derivatives as SSRIs | H. LUNDBECK A/S (DK) | 2010-01-26 | — | — | US | claimed |