Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 6/20 | 0.39 |
| ▸ | HTR1D | P28221 | 5/20 | 0.39 |
| ▸ | HTR2A | P28223 | 5/20 | 0.39 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549609 | 0.87 | DRD4 (0.58) | DRD4POLBMEN1KMT2ADRD2 | |
| SCHEMBL8550252 | 0.87 | DRD4 (0.59) | DRD4POLBDRD2HTR2AHTR1A | |
| SCHEMBL8551575 | 0.84 | DRD4 (0.48) | DRD4DRD2HTR1DHTR2AHTR1A | |
| SCHEMBL8550687 | 0.84 | DRD4 (0.48) | DRD4POLBKMT2ADRD2HTR1D | |
| SCHEMBL8549471 | 0.84 | DRD4 (0.48) | DRD4DRD2HTR1DHTR2AHTR1A | |
| SCHEMBL8553551 | 0.84 | DRD4 (0.48) | DRD4DRD2HTR1DHTR2AHTR1A | |
| SCHEMBL8549399 | 0.84 | CCR3 (0.56) | DRD4KMT2ADRD2HTR1AMAPT | |
| SCHEMBL8550036 | 0.83 | DRD4 (0.47) | DRD4POLBMEN1KMT2ADRD2 | |
| SCHEMBL8549100 | 0.83 | DRD4 (0.47) | DRD4MEN1KMT2ADRD2HTR1D | |
| SCHEMBL8549415 | 0.82 | DRD4 (0.49) | DRD4MEN1KMT2ADRD2HTR1D |
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 | disclosed |