Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 7/20 | 0.47 |
| ▸ | DRD2 | P14416 | 6/20 | 0.47 |
| ▸ | HTR2A | P28223 | 6/20 | 0.47 |
| ▸ | HTR1A | P08908 | 4/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8592579 | 1.00 | HTR1D (0.47) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8592577 | 1.00 | HTR1D (0.47) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL7405316 | 0.93 | ME2 (0.46) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8590591 | 0.91 | DRD2 (0.57) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8590585 | 0.91 | DRD2 (0.57) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8591792 | 0.91 | DRD2 (0.57) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8591793 | 0.88 | HTR1D (0.43) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8591794 | 0.88 | HTR1D (0.43) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL7399537 | 0.88 | MAPT (0.48) | HTR1DDRD2HTR2AHTR1ADRD4 | |
| SCHEMBL8591766 | 0.88 | MAPT (0.48) | HTR1DDRD2HTR2AHTR1ADRD4 |
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 | disclosed |
| WO-1997002259-A1 | 1,6-DISUBSTITUTED ISOCHROMANS FOR TREATMENT OF MIGRAINE HEADACHES | PHARMACIA & UPJOHN COMPANY (US) | 1997-01-23 | — | — | WO | disclosed |