Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.64 |
| ▸ | HTR1A | P08908 | 10/20 | 0.61 |
| ▸ | DRD2 | P14416 | 2/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.58 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL9206713 | 0.92 | HTR2A (0.53) | HTR2AHTR1ADRD2ADRA2AADRA2B | |
| SCHEMBL9209749 | 0.87 | HTR1A (0.48) | HTR2AHTR1ADRD2 | |
| SCHEMBL9206746 | 0.87 | HTR1A (0.58) | HTR1ADRD2 | |
| SCHEMBL9206516 | 0.86 | HTR2A (0.60) | HTR2AHTR1ADRD2ADRA2AADRA2B | |
| SCHEMBL9209449 | 0.85 | MPO (0.62) | HTR1A | |
| SCHEMBL9213179 | 0.84 | HTR2A (0.60) | HTR2AHTR1ADRD2 | |
| Hydrochloric Acid SCHEMBL9214057 | 0.83 | HTR2A (0.58) | HTR2AHTR1ADRD2 | |
| SCHEMBL9213108 | 0.80 | HTR1A (0.69) | HTR1ADRD2ADRA1A | |
| SCHEMBL25249411 | 0.79 | HTR2A (1.00) | HTR2AHTR1ADRD2ADRA2AADRA2B | |
| SCHEMBL24723815 | 0.79 | HTR2A (0.97) | HTR2AHTR1ADRD2ADRA2AADRA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0345808-B1 | 1-Indolylalkyl-4-(substituted-pyridinyl)piperazines | BRISTOL MYERS SQUIBB CO (US) | 1995-01-11 | — | — | EP | claimed |
| US-4954502-A | Antidepressants | BRISTOL-MYERS SQUIBB COMPANY (US) | 1990-09-04 | — | — | US | claimed |
| EP-0345808-A1 | 1-Indolylalkyl-4-(substituted-pyridinyl)piperazines | Bristol-Myers Squibb Company (US) | 1989-12-13 | — | — | EP | claimed |