Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 20/20 | 0.76 |
| ▸ | HTR1B | P28222 | 20/20 | 0.76 |
| ▸ | HTR2A | P28223 | 1/20 | 0.76 |
| ▸ | HTR2C | P28335 | 1/20 | 0.76 |
| ▸ | HTR1F | P30939 | 1/20 | 0.76 |
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 | |
|---|---|---|---|---|
| SCHEMBL8102054 | 0.89 | HTR1D (0.80) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7479048 | 0.87 | HTR1D (1.00) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7477108 | 0.86 | HTR1D (1.00) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7474899 | 0.85 | HTR1D (0.88) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7475369 | 0.84 | HTR1D (0.79) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8984359 | 0.83 | HTR1D (1.00) | HTR1DHTR1B | |
| SCHEMBL8412874 | 0.82 | HTR1D (0.53) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7475724 | 0.82 | HTR1D (1.00) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL7474143 | 0.82 | HTR1D (1.00) | HTR1DHTR1B | |
| SCHEMBL7481042 | 0.81 | HTR1D (1.00) | HTR1DHTR1BHTR2AHTR2CHTR1F |
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 5 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 |
| EP-0844996-A1 | SUBSTITUTED 1-INDOLYLPROPYL-4-PHENETHYLPIPERAZINE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1998-06-03 | — | — | EP | claimed |
| WO-1997006159-A1 | SUBSTITUTED 1-INDOLYLPROPYL-4-PHENETHYLPIPERAZINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1997-02-20 | — | — | WO | claimed |
| EP-0925302-B1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO INC (US) | 2002-11-20 | — | — | EP | disclosed |
| US-5889008-A | Substituted 1-indolylpropyl-4-phenethylpiperazadine derivatives | MERCK SHARP & DOHME, LTD. (GB) | 1999-03-30 | — | — | US | disclosed |