Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 16/20 | 0.60 |
| ▸ | HTR2A | P28223 | 14/20 | 0.60 |
| ▸ | HTR2B | P41595 | 2/20 | 0.60 |
| ▸ | DRD2 | P14416 | 12/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.33 |
| ▸ | CDK9 | P50750 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5636264 | 0.86 | HTR2C (0.65) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636352 | 0.84 | HTR2C (0.65) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL6501834 | 0.82 | HTR2C (0.41) | HTR2CHTR2AHTR2BCCNT1CDK9 | |
| SCHEMBL5637153 | 0.81 | HTR2C (0.76) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636500 | 0.79 | HTR2C (0.64) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5637996 | 0.79 | HTR2C (0.65) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5636579 | 0.79 | HTR2C (0.65) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5635672 | 0.78 | HTR2C (0.64) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL6783689 | 0.77 | HTR2C (0.37) | HTR2CHTR2AHTR2BHPGDLTA4H | |
| SCHEMBL5637498 | 0.77 | HTR2C (0.59) | 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 |