Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 7/20 | 0.59 |
| ▸ | DRD2 | P14416 | 7/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 4/20 | 0.49 |
| ▸ | HTR2A | P28223 | 3/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554330 | 0.90 | CD274 (0.59) | DRD3DRD2CD274HTR1AEPHX2 | |
| SCHEMBL8551190 | 0.87 | HTR1A (0.64) | DRD3DRD2CD274HTR1AMAPT | |
| SCHEMBL8549507 | 0.83 | HTR7 (0.45) | DRD3DRD2ADRA1AHTR2AMAPT | |
| SCHEMBL8553219 | 0.82 | HTR1A (0.52) | DRD3DRD2HTR1AMAPTPOLB | |
| SCHEMBL8548777 | 0.81 | HTR1D (0.54) | DRD2HTR1AHTR2APOLBHSD17B10 | |
| SCHEMBL24076498 | 0.81 | DRD2 (0.66) | DRD3DRD2ADRA1AHTR1AHTR2A | |
| SCHEMBL30301412 | 0.81 | DRD2 (0.66) | DRD3DRD2ADRA1AHTR1AHTR2A | |
| SCHEMBL8550457 | 0.80 | HTR1A (0.51) | DRD3DRD2HTR1AMAPTPOLB | |
| SCHEMBL8549479 | 0.79 | HTR1A (0.50) | DRD3DRD2HTR1AMAPTPOLB | |
| SCHEMBL8549853 | 0.79 | DRD4 (0.65) | DRD3DRD2HTR1AHTR2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0836599-A1 | 1,6-DISUBSTITUTED ISOCHROMANS FOR TREATMENT OF MIGRAINE HEADACHES | PHARMACIA & UPJOHN COMPANY (US) | 1998-04-22 | — | — | EP | claimed |