Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 20/20 | 0.76 |
| ▸ | HTR1B | P28222 | 11/20 | 0.76 |
| ▸ | DRD2 | P14416 | 3/20 | 0.61 |
| ▸ | HTR2A | P28223 | 3/20 | 0.61 |
| ▸ | HTR1A | P08908 | 3/20 | 0.61 |
| ▸ | DRD4 | P21917 | 1/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL8811237 | 0.88 | HTR1D (0.67) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL6812051 | 0.86 | HTR1D (1.00) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL8551188 | 0.86 | HTR1D (0.78) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL27563581 | 0.84 | HTR1D (0.78) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL5090663 | 0.84 | HTR1D (0.78) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL8554794 | 0.83 | HTR1D (0.53) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL7408003 | 0.82 | DRD2 (0.61) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| Hydrochloric Acid SCHEMBL7406756 | 0.81 | DRD2 (0.60) | HTR1DHTR1BDRD2HTR2AHTR1A | |
| SCHEMBL6811594 | 0.81 | HTR1D (0.82) | HTR1DHTR1BDRD2HTR1ASLC6A4 | |
| SCHEMBL6812692 | 0.81 | HTR1D (0.82) | HTR1DHTR1BDRD2HTR1ASLC6A4 |
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-0836599-A1 | 1,6-DISUBSTITUTED ISOCHROMANS FOR TREATMENT OF MIGRAINE HEADACHES | PHARMACIA & UPJOHN COMPANY (US) | 1998-04-22 | — | — | EP | claimed |
| EP-0836599-A1 | 1,6-DISUBSTITUTED ISOCHROMANS FOR TREATMENT OF MIGRAINE HEADACHES | PHARMACIA & UPJOHN COMPANY (US) | 1998-04-22 | — | — | EP | disclosed |