Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 12/20 | 0.66 |
| ▸ | HTR2B | P41595 | 7/20 | 0.54 |
| ▸ | HTR2A | P28223 | 4/20 | 0.54 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5635089 | 0.90 | HTR2C (0.73) | HTR2CHTR2BHTR2ADRD2 | |
| SCHEMBL5636633 | 0.88 | HTR2C (0.61) | HTR2CHTR2BHTR2ADRD2 | |
| SCHEMBL5637112 | 0.87 | HTR2C (0.64) | HTR2CHTR2BHTR2ADRD2CHRNB2 | |
| SCHEMBL5636637 | 0.87 | HTR2C (0.64) | HTR2CHTR2BHTR2ADRD2CHRNB2 | |
| SCHEMBL5636558 | 0.87 | HTR2C (0.80) | HTR2CHTR2BHTR2ADRD2 | |
| SCHEMBL5636899 | 0.86 | HTR2C (0.70) | HTR2CHTR2BHTR2ADRD2CHRNB2 | |
| SCHEMBL5637426 | 0.86 | HTR2C (0.70) | HTR2CHTR2BHTR2ADRD2CHRNB2 | |
| SCHEMBL5636212 | 0.86 | HTR2C (0.67) | HTR2CHTR2BHTR2ACHRNB2CHRNB4 | |
| SCHEMBL5638716 | 0.84 | HTR2C (0.72) | HTR2CHTR2BHTR2ADRD2 | |
| SCHEMBL5637748 | 0.84 | HTR2C (0.81) | HTR2CHTR2BHTR2ADRD2 |
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 |