Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 15/20 | 0.44 |
| ▸ | HTR1A | P08908 | 5/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.44 |
| ▸ | HTR3B | O95264 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.44 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 6/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19005555 | 0.75 | HTR2A (0.32) | HTR2CHTR2AMCHR1 | |
| SCHEMBL19005519 | 0.74 | HTR2C (0.38) | HTR2CHTR1AHTR3EHTR3BHTR3A | |
| SCHEMBL19005562 | 0.71 | HTR2A (0.31) | HTR2CHTR2A | |
| SCHEMBL29539173 | 0.70 | HTR2A (0.50) | HTR2CHTR3AHTR2AMCHR1 | |
| SCHEMBL19005523 | 0.70 | MCHR1 (0.37) | HTR2CHTR2AMCHR1 | |
| SCHEMBL839815 | 0.70 | HTR2A (0.50) | HTR2CHTR3AHTR2AMCHR1 | |
| SCHEMBL19005524 | 0.69 | MCHR1 (0.36) | HTR2CHTR2AMCHR1 | |
| SCHEMBL19005518 | 0.69 | HTR2A (0.35) | HTR2CHTR2AMCHR1 | |
| Hydrochloric Acid SCHEMBL20139551 | 0.69 | HTR2A (0.49) | HTR2CHTR3AHTR2AMCHR1 | |
| SCHEMBL19005559 | 0.68 | HTR2C (0.34) | HTR2CHTR2AMCHR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017101796-A1 | PHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2017-06-22 | — | — | WO | disclosed |