Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL19005736 | 0.75 | CHRNB4 (0.35) | CHRNB4CHRNA3 | |
| SCHEMBL19005650 | 0.72 | CHRNB4 (0.35) | CHRNB4CHRNA3 | |
| SCHEMBL12256566 | 0.69 | PDPK1 (0.41) | TDO2PDPK1 | |
| SCHEMBL24377327 | 0.69 | PDPK1 (0.35) | PDPK1 | |
| SCHEMBL19005654 | 0.69 | SIGMAR1 (0.40) | — | |
| SCHEMBL13749951 | 0.69 | — | — | |
| SCHEMBL12090439 | 0.67 | CHRNB2 (0.44) | CHRNB4CHRNA3 | |
| SCHEMBL21672415 | 0.67 | PDPK1 (0.39) | PDPK1 | |
| SCHEMBL24377496 | 0.67 | PDPK1 (0.39) | PDPK1 | |
| SCHEMBL19005767 | 0.67 | CHRNB4 (0.38) | L3MBTL3CHRNB4CHRNA3 |
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 |