Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 6/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4351623 | 0.91 | MPO (0.54) | HTR1AMPOSLC6A4 | |
| SCHEMBL16433177 | 0.88 | MPO (0.55) | HTR1AMPOSLC6A4 | |
| SCHEMBL28496644 | 0.84 | MPO (0.51) | HTR2AHTR1AMPOSLC6A4 | |
| SCHEMBL320187 | 0.84 | NR3C1 (0.52) | HTR1ANR3C1SLC6A4 | |
| SCHEMBL5637174 | 0.83 | HTR2A (0.55) | HTR2AHTR1AGPR84NR3C1MPO | |
| SCHEMBL7281690 | 0.81 | NR3C1 (0.51) | HTR1ANR3C1SLC6A4 | |
| SCHEMBL9215791 | 0.80 | SLC6A4 (0.52) | HTR2AHTR1AGPR84SLC6A4 | |
| SCHEMBL16433094 | 0.79 | MAPT (0.57) | HTR2AHTR1AGPR84SLC6A4 | |
| SCHEMBL16433322 | 0.78 | SLC6A4 (0.55) | HTR1ASLC6A4 | |
| SCHEMBL16432776 | 0.77 | SLC6A4 (0.51) | HTR2AHTR1AGPR84SLC6A4 |
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-0464604-B1 | 1-Indolylalkyl-4-(alkoxy-pyrimidinyl)piperazines | BRISTOL MYERS SQUIBB CO (US) | 1995-03-29 | — | — | EP | disclosed |
| EP-0464558-B1 | Antimigraine alkoxypyrimidine derivatives | BRISTOL MYERS SQUIBB CO (US) | 1994-12-28 | — | — | EP | disclosed |
| EP-0464604-A2 | 1-Indolylalkyl-4-(alkoxy-pyrimidinyl)piperazines | Bristol-Myers Squibb Company (US) | 1992-01-08 | — | — | EP | disclosed |
| EP-0464558-A1 | Antimigraine alkoxypyrimidine derivatives | Bristol-Myers Squibb Company (US) | 1992-01-08 | — | — | EP | disclosed |
| US-5077293-A | Antidepressants | BRISTOL-MYERS SQUIBB CO. (US) | 1991-12-31 | — | — | US | disclosed |