Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25A | P30304 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | CDC25C | P30307 | 1/20 | 0.42 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 3/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CDC14B | O60729 | 1/20 | 0.36 |
| ▸ | CDC14A | Q9UNH5 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL23558678 | 0.85 | CDC25A (0.41) | CDC25ACDC25BCDC25CKCNA3LTB4R | |
| SCHEMBL22854798 | 0.70 | CDC14B (0.51) | CDC25ACDC25BCDC25CCDC14BCDC14A | |
| SCHEMBL28155952 | 0.70 | CDC14B (0.51) | CDC14BCDC14AADORA3NPC1RAB9A | |
| SCHEMBL17917499 | 0.70 | CDC14B (0.51) | CDC25ACDC25BCDC25CCDC14BCDC14A | |
| SCHEMBL3874920 | 0.69 | IDO1 (0.39) | CDC25ACDC25BCDC25CKCNA3LTB4R | |
| SCHEMBL22707251 | 0.69 | CDC14B (0.50) | CDC14BCDC14AADORA3NPC1RAB9A | |
| SCHEMBL23027121 | 0.69 | CDC14B (0.50) | CDC14BCDC14AADORA3NPC1RAB9A | |
| SCHEMBL29671008 | 0.69 | CDC14B (0.52) | CDC14BCDC14AADORA3NPC1RAB9A | |
| SCHEMBL23559096 | 0.69 | CA1 (0.41) | CDC14BCDC14AADORA3NPC1RAB9A | |
| SCHEMBL12203192 | 0.69 | CDC14B (0.57) | CDC14BCDC14AADORA3NPC1RAB9A |
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-2021121230-A1 | COMPOUND, APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING SAME | 北京鼎材科技有限公司 | 2021-06-24 | — | — | WO | disclosed |