Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 7/20 | 0.47 |
| ▸ | DRD2 | P14416 | 6/20 | 0.46 |
| ▸ | HTR1D | P28221 | 5/20 | 0.46 |
| ▸ | DRD4 | P21917 | 3/20 | 0.46 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8550884 | 1.00 | HTR2A (0.49) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8550003 | 0.85 | HTR2A (0.48) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8549609 | 0.84 | DRD4 (0.58) | HTR2AHTR1ADRD2HTR1DDRD4 | |
| SCHEMBL8549749 | 0.84 | HTR2A (0.47) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8552920 | 0.83 | HTR2A (0.46) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8550144 | 0.83 | DRD2 (0.50) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8550575 | 0.82 | DRD2 (0.49) | HTR2AADRB1HTR2BSIGMAR1HTR1A | |
| SCHEMBL8550482 | 0.81 | DRD2 (0.49) | HTR2AHTR1ADRD2HTR1DDRD4 | |
| SCHEMBL8548703 | 0.81 | DRD2 (0.48) | HTR2AHTR1ADRD2HTR1DDRD4 | |
| SCHEMBL8554232 | 0.80 | DRD2 (0.47) | HTR2AHTR1ADRD2HTR1DDRD4 |
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 |