Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 11/20 | 0.51 |
| ▸ | HTR2A | P28223 | 10/20 | 0.51 |
| ▸ | HTR2B | P41595 | 8/20 | 0.51 |
| ▸ | BRPF1 | P55201 | 3/20 | 0.41 |
| ▸ | BRD1 | O95696 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | BRPF3 | Q9ULD4 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4313537 | 0.81 | HTR2C (0.42) | HTR2CHTR2AHTR2BBRPF1BRD1 | |
| SCHEMBL2639295 | 0.81 | HTR2C (0.42) | HTR2CHTR2AHTR2BBRPF1BRD1 | |
| SCHEMBL13931360 | 0.81 | HTR2C (0.53) | HTR2CHTR2AHTR2BHTR1ASLC6A2 | |
| SCHEMBL6219727 | 0.81 | HTR2A (0.53) | HTR2CHTR2AHTR2B | |
| SCHEMBL2419267 | 0.81 | HTR2A (0.53) | HTR2CHTR2AHTR2B | |
| SCHEMBL26669531 | 0.78 | GSK3B (0.40) | HTR2CHTR2AHTR2BBRPF1BRD1 | |
| SCHEMBL4349602 | 0.78 | GSK3B (0.40) | HTR2CHTR2AHTR2BBRPF1BRD1 | |
| SCHEMBL3331400 | 0.77 | HTR2C (0.50) | HTR2CHTR2AHTR2BDRD2 | |
| Hydrochloric Acid SCHEMBL26599874 | 0.77 | GSK3B (0.39) | HTR2CHTR2AHTR2BBRPF1BRD1 | |
| Hydrochloric Acid SCHEMBL26599886 | 0.77 | GSK3B (0.39) | HTR2CHTR2AHTR2BBRPF1BRD1 |
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 | disclosed |
| US-4954502-A | Antidepressants | BRISTOL-MYERS SQUIBB COMPANY (US) | 1990-09-04 | — | — | US | disclosed |
| EP-0345808-A1 | 1-Indolylalkyl-4-(substituted-pyridinyl)piperazines | Bristol-Myers Squibb Company (US) | 1989-12-13 | — | — | EP | disclosed |