Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 18/20 | 0.69 |
| ▸ | HTR2A | P28223 | 16/20 | 0.62 |
| ▸ | HTR2B | P41595 | 4/20 | 0.62 |
| ▸ | DRD2 | P14416 | 11/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | HTR1E | P28566 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5637561 | 0.92 | HTR2C (0.70) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636211 | 0.92 | HTR2C (0.70) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636902 | 0.91 | HTR2C (0.68) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636191 | 0.89 | HTR2C (0.66) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636247 | 0.89 | HTR2C (0.76) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL255569 | 0.89 | HTR2C (0.76) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636558 | 0.89 | HTR2C (0.80) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5635452 | 0.88 | HTR2C (0.69) | HTR2CHTR2AHTR2BDRD2HTR1A | |
| SCHEMBL5637189 | 0.88 | HTR2C (0.64) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5637598 | 0.88 | HTR2C (0.69) | HTR2CHTR2AHTR2BDRD2 |
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 |