Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 9/20 | 0.43 |
| ▸ | HTR1B | P28222 | 9/20 | 0.43 |
| ▸ | HTR1D | P28221 | 8/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8549160 | 0.94 | HTR2A (0.45) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL8545440 | 0.88 | HTR1A (0.55) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL8546408 | 0.82 | HTR1A (0.52) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL15678352 | 0.82 | HTR2A (0.56) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL8545081 | 0.81 | HTR1A (0.55) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL8549571 | 0.81 | HTR1B (0.37) | HTR2AHTR1AHTR1BHTR1DTHRA | |
| SCHEMBL8545281 | 0.80 | HTR2A (0.56) | HTR2AHTR2CHTR2BHTR1AHTR1D | |
| SCHEMBL8869200 | 0.77 | SLC6A4 (0.51) | HTR2AHTR2CHTR2BHTR1AKDM4E | |
| SCHEMBL8544351 | 0.77 | HTR2A (0.45) | HTR2AHTR2CHTR2BHTR1AHTR1B | |
| SCHEMBL8543442 | 0.75 | HTR1A (0.54) | HTR2AHTR2CHTR1AHTR1BHTR1D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0593513-B1 | TRYPTAMINE ANALOGUES, THEIR SYNTHESIS AND THEIR USE AS 5-HT1-LIKE RECEPTORS OR 5-HT2 RECEPTOR AGONISTES | SMITHKLINE BEECHAM PLC (GB) | 1998-10-28 | — | — | EP | disclosed |
| US-5571833-A | TREATMENT OF MIGRAINE, PORTAL HYPERTENSION | SMITHKLINE BEECHAM PLC (GB) | 1996-11-05 | — | — | US | disclosed |
| EP-0593513-A1 | TRYPTAMINE ANALOGUES, THEIR SYNTHESIS AND THEIR USE AS 5-HT1-LIKE RECEPTORS OR 5-HT2 RECEPTOR AGONISTES | SMITHKLINE BEECHAM PLC (GB) | 1994-04-27 | — | — | EP | disclosed |
| WO-1993000333-A1 | TRYPTAMINE ANALOGUES, THEIR SYNTHESIS AND THEIR USE AS 5-HT1-LIKE OR 5-HT2 RECEPTOR AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-01-07 | — | — | WO | disclosed |