Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 15/20 | 0.39 |
| ▸ | HTR2A | P28223 | 14/20 | 0.39 |
| ▸ | DRD2 | P14416 | 13/20 | 0.39 |
| ▸ | STS | P08842 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5636995 | 0.89 | HTR2C (0.41) | ALDH1A1PDE4BHTR2CHTR2ADRD2 | |
| SCHEMBL5637177 | 0.88 | HTR2C (0.42) | HTR2CHTR2ADRD2 | |
| SCHEMBL5637490 | 0.88 | HTR2C (0.42) | HTR2CHTR2ADRD2 | |
| SCHEMBL5634923 | 0.88 | HTR2C (0.43) | HTR2CHTR2ADRD2 | |
| SCHEMBL5636432 | 0.88 | HTR2C (0.43) | HTR2CHTR2ADRD2 | |
| SCHEMBL5637898 | 0.88 | HTR2C (0.43) | HTR2CHTR2ADRD2 | |
| SCHEMBL5638532 | 0.88 | HTR2C (0.39) | PDE4BHTR2CHTR2ADRD2 | |
| SCHEMBL5636952 | 0.86 | PDE4B (0.40) | PDE4BHTR2CHTR2ADRD2 | |
| SCHEMBL5639095 | 0.86 | GPR119 (0.39) | HTR2CHTR2ADRD2 | |
| SCHEMBL5638977 | 0.86 | HTR2C (0.38) | HTR2CHTR2ADRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE39679-E1 | Substituted heterocycle fused gamma-carbolines | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2007-06-05 | — | — | US | disclosed |
| US-6713471-B1 | SUCH AS TERT-BUTYL-1-METHYL-6,7,9,12-TETRAHYDRO-5H-PYRIDO-(4,3-B)(1,4) THIAZEPINO(2,3,4-HI)INDOLE-11(10H)-CARBOXYLATE; SEROTONIN AGONISTS AND ANTAGONISTS; CENTRAL NERVOUS SYSTEM DISORDERS | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2004-03-30 | — | — | US | disclosed |