Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 5/20 | 0.58 |
| ▸ | DRD2 | P14416 | 8/20 | 0.51 |
| ▸ | HTR2A | P28223 | 7/20 | 0.51 |
| ▸ | HTR1D | P28221 | 6/20 | 0.51 |
| ▸ | HTR1A | P08908 | 5/20 | 0.51 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | SOD1 | P00441 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549415 | 0.91 | DRD4 (0.49) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8549471 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8553551 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8551575 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8550687 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8550263 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8549485 | 0.90 | DRD4 (0.48) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8550144 | 0.89 | DRD2 (0.50) | DRD4DRD2HTR2AHTR1DHTR1A | |
| SCHEMBL8550252 | 0.89 | DRD4 (0.59) | DRD4DRD2HTR2AHTR1APOLB | |
| SCHEMBL8550575 | 0.89 | DRD2 (0.49) | DRD4DRD2HTR2AHTR1DHTR1A |
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 |