Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | IDE | P14735 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 3/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10034635 | 1.00 | MITF (0.32) | MITFAPAF1IDEL3MBTL1HTR2C | |
| SCHEMBL15108640 | 1.00 | MITF (0.32) | MITFAPAF1IDEL3MBTL1HTR2C | |
| Tert-Butyl Formate SCHEMBL28055268 | 0.84 | TDP1 (0.34) | HTR2CHTR2AKCNH2 | |
| Tert-Butyl Formate SCHEMBL28055267 | 0.84 | TDP1 (0.34) | HTR2CHTR2AKCNH2 | |
| SCHEMBL26614878 | 0.83 | HTR2A (0.31) | MITFHTR2CHTR2AHTR2B | |
| SCHEMBL27232474 | 0.83 | HTR2A (0.31) | MITFHTR2CHTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL28321800 | 0.81 | HTR2A (0.30) | HTR2CHTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL28321798 | 0.81 | HTR2A (0.30) | HTR2CHTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL28321801 | 0.81 | HTR2A (0.30) | HTR2CHTR2AHTR2B | |
| SCHEMBL29784806 | 0.81 | TDP1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105294655-B | The compound and application thereof of CDK type small molecular inhibitor | 广东东阳光药业有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-105294655-A | CDK small-molecule inhibitor compounds and application therefore | GUANGDONG HEC PHARMACEUTICAL | 2016-02-03 | — | — | CN | disclosed |