Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.31 |
| ▸ | HTR2C | P28335 | 5/20 | 0.31 |
| ▸ | HTR2B | P41595 | 5/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19005738 | 0.76 | TDO2 (0.30) | — | |
| SCHEMBL19005660 | 0.76 | CHRNB2 (0.31) | — | |
| SCHEMBL19005800 | 0.73 | — | — | |
| SCHEMBL19005647 | 0.71 | KDM4E (0.41) | HTR2AHTR2CHTR2B | |
| SCHEMBL19005652 | 0.71 | MEN1 (0.35) | — | |
| SCHEMBL19005646 | 0.70 | CHRNB2 (0.34) | HTR2AHTR2CHTR2B | |
| SCHEMBL9201196 | 0.66 | — | — | |
| SCHEMBL21945204 | 0.66 | — | — | |
| SCHEMBL15807962 | 0.66 | — | — | |
| SCHEMBL30892164 | 0.66 | — | — |
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 |