Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 12/20 | 0.97 |
| ▸ | HTR1D | P28221 | 12/20 | 0.97 |
| ▸ | HTR1B | P28222 | 11/20 | 0.97 |
| ▸ | HTR2A | P28223 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.63 |
| ▸ | TRPM8 | Q7Z2W7 | 4/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | HTR2C | P28335 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL14975308 | 0.99 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL1913860 | 0.90 | HTR1A (0.81) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| Pyrrole SCHEMBL28770264 | 0.89 | HTR1A (0.85) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL4512060 | 0.85 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL29018529 | 0.85 | HTR1A (0.78) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL5461625 | 0.84 | HTR1A (0.71) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| Hydrochloric Acid SCHEMBL7809324 | 0.84 | HTR1A (0.97) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL8299143 | 0.82 | HTR1A (0.77) | HTR1AHTR1DHTR1BHTR2AMAPT | |
| SCHEMBL10778563 | 0.82 | HTR1A (0.74) | HTR1AHTR1DHTR1BMPO | |
| SCHEMBL11290643 | 0.81 | HTR1A (0.72) | HTR1AHTR1DHTR1BHTR2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5607960-A | Indole derivatives as 5-HT1-like agonists for use in migraine | PFIZER INC. (US) | 1997-03-04 | — | — | US | disclosed |
| EP-0695301-B1 | INDOLE DERIVATIVES AS 5-HT1-LIKE AGONISTS FOR USE IN MIGRAINE | PFIZER LTD (GB) | 1996-10-30 | — | — | EP | disclosed |