Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKAG1 | P54619 | 10/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 10/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 10/20 | 0.38 |
| ▸ | PRKAA2 | P54646 | 9/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 8/20 | 0.38 |
| ▸ | PRKAG3 | Q9UGI9 | 8/20 | 0.38 |
| ▸ | PRKAG2 | Q9UGJ0 | 8/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 4/20 | 0.33 |
| ▸ | TEK | Q02763 | 4/20 | 0.33 |
| ▸ | HTR1D | P28221 | 2/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6962926 | 0.83 | HTR1D (0.47) | SLC6A2SLC6A4SLC6A3HTR1D | |
| SCHEMBL6964366 | 0.83 | HTR1D (0.38) | PRKAG1PRKAA1PRKAB1PRKAA2PRKAB2 | |
| SCHEMBL6970050 | 0.82 | SLC6A2 (0.32) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6974690 | 0.80 | TLR9 (0.41) | HTR1D | |
| SCHEMBL8507358 | 0.79 | HTR1D (0.45) | SLC6A2SLC6A4SLC6A3HTR1D | |
| SCHEMBL6971259 | 0.79 | SLC6A2 (0.32) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8208352 | 0.78 | HTR1D (0.40) | SLC6A2SLC6A4SLC6A3HTR1D | |
| SCHEMBL9287655 | 0.77 | HTR1D (0.42) | SLC6A2SLC6A4SLC6A3HTR1D | |
| SCHEMBL774639 | 0.77 | SLC6A4 (0.43) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8209129 | 0.77 | SLC6A4 (0.43) | SLC6A2SLC6A4SLC6A3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0944595-B1 | 5-CYCLO INDOLE COMPOUNDS AS 5-HT1D RECEPTOR LIGANDS | NPS ALLELIX CORP (CA) | 2003-10-01 | — | — | EP | claimed |
| US-5998438-A | SEROTONIN RECEPTOR ANTAGONIST; HEADACHE THERAPY | ALLELIX BIOPHARMACEUTICALS, INC. (CA) | 1999-12-07 | — | — | US | claimed |
| EP-0944595-B1 | 5-CYCLO INDOLE COMPOUNDS AS 5-HT1D RECEPTOR LIGANDS | NPS ALLELIX CORP (CA) | 2003-10-01 | — | — | EP | disclosed |
| US-5998438-A | SEROTONIN RECEPTOR ANTAGONIST; HEADACHE THERAPY | ALLELIX BIOPHARMACEUTICALS, INC. (CA) | 1999-12-07 | — | — | US | disclosed |