Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 9/20 | 0.68 |
| ▸ | HTR2A | P28223 | 9/20 | 0.68 |
| ▸ | HTR6 | P50406 | 8/20 | 0.68 |
| ▸ | OPRK1 | P41145 | 8/20 | 0.68 |
| ▸ | HTR2C | P28335 | 8/20 | 0.68 |
| ▸ | HTR2B | P41595 | 8/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.68 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.68 |
| ▸ | ADRA2C | P18825 | 7/20 | 0.68 |
| ▸ | HRH1 | P35367 | 7/20 | 0.68 |
| ▸ | HTR1D | P28221 | 6/20 | 0.68 |
| ▸ | HTR1E | P28566 | 6/20 | 0.68 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.68 |
| ▸ | DRD3 | P35462 | 6/20 | 0.68 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.68 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.68 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.68 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7134010 | 0.81 | HTR2A (1.00) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| SCHEMBL29436147 | 0.79 | HTR2A (0.58) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| SCHEMBL11177660 | 0.79 | HTR2A (0.58) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| SCHEMBL7429830 | 0.76 | HTR2A (0.63) | HTR1AHTR2AHTR6HTR2CHTR2B | |
| SCHEMBL18320650 | 0.75 | OPRK1 (0.57) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| SCHEMBL18085058 | 0.75 | HTR1A (0.76) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| Fumaric Acid SCHEMBL7382409 | 0.75 | KDM4E (0.55) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| Fumaric Acid SCHEMBL7382417 | 0.75 | KDM4E (0.55) | HTR1AHTR2AHTR6OPRK1HTR2C | |
| SCHEMBL28787727 | 0.74 | AHR (0.52) | HTR1AHTR2AHTR6HTR2CHTR1D | |
| SCHEMBL24243748 | 0.73 | HTR1A (0.84) | HTR1AHTR2AHTR6OPRK1HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-6187805-B1 | TREATING CONDITION FOR WHICH SELECTIVE AGONISM OR ANTAGONISM OF 5-HT-6 RECEPTORS IS INDICATED BY ADMINISTERING COMPOUNDS SUCH AS N,N-DIMETHYL 2-(1-(BENZENESULPHONYL)-5-METHOXY-1H-INDOL-3-YL)ETHYLAMINE | MERCK SHARP & DOHME LTD. (GB) | 2001-02-13 | — | — | US | disclosed |