Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.76 |
| ▸ | HTR2C | P28335 | 6/20 | 0.76 |
| ▸ | HTR1D | P28221 | 3/20 | 0.59 |
| ▸ | HTR1B | P28222 | 2/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR5A | P47898 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8783632 | 0.86 | HTR1A (1.00) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| SCHEMBL8784222 | 0.82 | HTR1A (0.58) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| Oxalic Acid SCHEMBL8900028 | 0.81 | HTR1A (0.88) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| SCHEMBL8783651 | 0.80 | HTR1A (0.76) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| SCHEMBL8784080 | 0.77 | HTR1A (0.60) | HTR1AHTR2CHTR1DHTR1B | |
| SCHEMBL8900030 | 0.76 | HTR1A (0.63) | HTR1AHTR2CHTR1DHTR1B | |
| SCHEMBL8784905 | 0.75 | HTR1A (0.70) | HTR1AHTR2CHTR1DHTR1B | |
| SCHEMBL4512060 | 0.75 | HTR1A (1.00) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| SCHEMBL8784514 | 0.74 | HTR1A (1.00) | HTR1AHTR2CHTR1DHTR1BHTR2A | |
| SCHEMBL31371849 | 0.74 | HTR1A (0.67) | HTR1AHTR2CHTR1DHTR1BHTR2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0497512-B1 | Imidazole, triazole and tetrazole derivatives | MERCK SHARP & DOHME (GB) | 1997-09-24 | — | — | EP | disclosed |
| EP-0778275-A1 | Process for the preparation of imidazole, triazole and tetrazole derivatives and their use as selective 5-HT-1 receptor agonists | MERCK SHARP & DOHME LTD. (GB) | 1997-06-11 | — | — | EP | disclosed |
| US-5602163-A | SELECTIVE AGONISTS OF 5-HYDROXYTRYPTAMINE RECEPTORS; USEFUL IN TREATMENT OF MIGRAINE HEADACHES | MERCK, SHARP & DOHME LTD. (GB) | 1997-02-11 | — | — | US | disclosed |
| US-5602162-A | TREATMENT AND/OR PREVENTION OF MIGRAINE | MERCK, SHARP & DOHME LTD. (GB) | 1997-02-11 | — | — | US | disclosed |
| US-5451588-A | Treatment of migraines | MERCK SHARP & DOHME LTD. (GB) | 1995-09-19 | — | — | US | disclosed |
| US-5298520-A | Triazole containing indole derivatives | MERCK SHARP & DOHME LIMITED (GB) | 1994-03-29 | — | — | US | disclosed |
| EP-0497512-A2 | Imidazole, triazole and tetrazole derivatives | MERCK SHARP & DOHME LTD. (GB) | 1992-08-05 | — | — | EP | disclosed |