Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 19/20 | 1.00 |
| ▸ | HTR1B | P28222 | 19/20 | 1.00 |
| ▸ | HTR1A | P08908 | 5/20 | 1.00 |
| ▸ | HTR2A | P28223 | 5/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7478800 | 1.00 | HTR1D (1.00) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| SCHEMBL7477437 | 0.87 | HTR1D (1.00) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| SCHEMBL7477433 | 0.87 | HTR1D (1.00) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| SCHEMBL7480744 | 0.87 | HTR1D (0.83) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| SCHEMBL7474847 | 0.82 | HTR1D (0.82) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL8093323 | 0.81 | HTR1D (1.00) | HTR1DHTR1BHTR1AHTR2A | |
| Fumaric Acid SCHEMBL7813408 | 0.79 | HTR1D (0.65) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| Maleic Acid SCHEMBL7813403 | 0.79 | HTR1D (0.65) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| Fumaric Acid SCHEMBL7813410 | 0.79 | HTR1D (0.65) | HTR1DHTR1BHTR1AHTR2AKMT2A | |
| SCHEMBL7481032 | 0.77 | HTR1D (0.66) | HTR1DHTR1BHTR1AHTR2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | claimed |
| US-6025374-A | Azetidine, pyrrolidine and piperidine derivatives as 5HT1 receptor agonists | MERCK SHARP & DOHME, LTD. (GB) | 2000-02-15 | — | — | US | claimed |
| US-5808064-A | HYDROSILATION OF AN INDOLE AS CHEMICAL INTERMEDIATE | MERCK & CO., INC. (US) | 1998-09-15 | — | — | US | claimed |
| EP-0796258-A1 | AZETIDINE, PYRROLIDINE AND PIPERIDINE DERIVATIVES AS 5HT1 RECEPTOR AGONISTS | MERCK SHARP & DOHME LTD. (GB) | 1997-09-24 | — | — | EP | claimed |
| WO-1996017842-A1 | AZETIDINE, PYRROLIDINE AND PIPERIDINE DERIVATIVES AS 5HT1 RECEPTOR AGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1996-06-13 | — | — | WO | claimed |
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | disclosed |
| US-6025374-A | Azetidine, pyrrolidine and piperidine derivatives as 5HT1 receptor agonists | MERCK SHARP & DOHME, LTD. (GB) | 2000-02-15 | — | — | US | disclosed |
| US-5808064-A | HYDROSILATION OF AN INDOLE AS CHEMICAL INTERMEDIATE | MERCK & CO., INC. (US) | 1998-09-15 | — | — | US | disclosed |