Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 3/20 | 0.60 |
| ▸ | HTR1D | P28221 | 11/20 | 0.60 |
| ▸ | HTR1B | P28222 | 9/20 | 0.60 |
| ▸ | HTR2A | P28223 | 3/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
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 | 0.90 | HTR1D (0.69) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL6964363 | 0.87 | MPO (0.59) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL6968099 | 0.82 | HTR1D (0.55) | MPOHTR1DHTR1BHTR2A | |
| SCHEMBL6960599 | 0.82 | MPO (0.56) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL7007317 | 0.80 | MPO (0.54) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL6974695 | 0.80 | SLC6A4 (0.65) | HTR1D | |
| SCHEMBL29555911 | 0.78 | HTR1D (0.56) | HTR1D | |
| SCHEMBL6966978 | 0.78 | MPO (0.57) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL6968102 | 0.78 | HTR1D (0.48) | MPOHTR1DHTR1BHTR2ABRD4 | |
| SCHEMBL6970059 | 0.77 | MPO (0.56) | MPOHTR1DHTR1BHTR2ABRD4 |
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 |