Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 12/20 | 1.00 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.65 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.65 |
| ▸ | HTR2A | P28223 | 2/20 | 0.58 |
| ▸ | HTR2C | P28335 | 2/20 | 0.58 |
| ▸ | HTR2B | P41595 | 2/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.58 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12998412 | 1.00 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL9903945 | 1.00 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL299296 | 1.00 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL30584623 | 1.00 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL9903949 | 1.00 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| Hydrochloric Acid SCHEMBL9731477 | 0.98 | SIGMAR1 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL16687781 | 0.82 | SIGMAR1 (0.70) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL11881965 | 0.80 | SIGMAR1 (0.66) | SIGMAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL814886 | 0.79 | SLC6A2 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL814887 | 0.79 | SLC6A2 (1.00) | SIGMAR1SLC6A2SLC6A4SLC6A3CYP3A4 |
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-2427183-A2 | THERAPEUTIC COMPOUNDS | University of Florida Research Foundation, Inc. (US) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010129048-A2 | THERAPEUTIC COMPOUNDS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2010-11-11 | — | — | WO | disclosed |