Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 6/20 | 0.55 |
| ▸ | HTR1B | P28222 | 4/20 | 0.55 |
| ▸ | MPO | P05164 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6962933 | 0.84 | HTR1D (0.69) | HTR1DHTR1BMPOHTR2A | |
| SCHEMBL6974697 | 0.82 | MPO (0.60) | HTR1DHTR1BMPOHTR2A | |
| SCHEMBL6964363 | 0.81 | MPO (0.59) | HTR1DHTR1BMPOHTR2A | |
| SCHEMBL11785874 | 0.81 | KCNH2 (0.61) | OPRM1OPRK1OPRL1DRD2DRD4 | |
| SCHEMBL6968414 | 0.78 | DRD3 (0.56) | HTR1DHTR1BMPOOPRM1OPRL1 | |
| SCHEMBL11333398 | 0.77 | DRD2 (0.76) | DRD2DRD4DRD3HTR2A | |
| SCHEMBL7007317 | 0.77 | MPO (0.54) | HTR1DHTR1BMPOHTR2A | |
| SCHEMBL6960599 | 0.77 | MPO (0.56) | HTR1DHTR1BMPOHTR2A | |
| SCHEMBL25240962 | 0.75 | SLC6A4 (0.81) | HTR6KCNH2 | |
| SCHEMBL892983 | 0.75 | HTR6 (0.58) | HTR1DHTR1BOPRM1OPRK1OPRL1 |
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 |