Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.56 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 2/20 | 0.43 |
| ▸ | HTR1B | P28222 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7014117 | 1.00 | SLC6A4 (0.56) | SLC6A4HTR6MTNR1AMTNR1BALDH1A1 | |
| SCHEMBL7003242 | 0.83 | SLC6A4 (0.57) | SLC6A4HTR6MTNR1AMTNR1BHTR1D | |
| SCHEMBL6995996 | 0.83 | SLC6A4 (0.59) | SLC6A4MTNR1AMTNR1BHTR1DHTR1B | |
| SCHEMBL6642008 | 0.82 | HTR1D (0.63) | SLC6A4MTNR1AMTNR1BHTR1DHTR1B | |
| SCHEMBL4677184 | 0.81 | HTR1D (0.65) | HTR6HTR1DHTR1BHTR1ACYP1A2 | |
| SCHEMBL6996942 | 0.80 | SLC6A4 (0.61) | SLC6A4ALDH1A1HTR1DHTR1BOPRM1 | |
| SCHEMBL8381443 | 0.80 | CYP1A2 (0.63) | SLC6A4MTNR1AMTNR1BHTR1DHTR1B | |
| SCHEMBL7011235 | 0.80 | SLC6A4 (0.84) | SLC6A4HTR1BOPRM1OPRK1OPRL1 | |
| SCHEMBL8385502 | 0.78 | HTR1D (0.51) | SLC6A4HTR1DHTR1BHTR1A | |
| SCHEMBL7002497 | 0.77 | SLC6A4 (0.61) | SLC6A4HTR1DHTR1BOPRM1OPRK1 |
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-1105393-B1 | BICYCLIC PIPERIDINE AND PIPERAZINE COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY | NPS ALLELIX CORP (CA) | 2003-10-01 | — | — | EP | disclosed |
| US-6251893-B1 | TREATING CENTRAL NERVOUS SYSTEM DISORDERS | NPS ALLELIX CORP. (CA) | 2001-06-26 | — | — | US | disclosed |