Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.36 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL16613451 | 0.88 | ALDH1A1 (0.32) | — | |
| SCHEMBL16613458 | 0.86 | MCL1 (0.35) | ADORA1ADORA2AMCL1 | |
| SCHEMBL16613605 | 0.86 | ALDH1A1 (0.31) | — | |
| SCHEMBL16613640 | 0.86 | MCL1 (0.39) | MCL1 | |
| SCHEMBL16613600 | 0.85 | ALDH1A1 (0.32) | — | |
| SCHEMBL16613250 | 0.85 | MCL1 (0.37) | MCL1 | |
| SCHEMBL16613644 | 0.85 | ALDH1A1 (0.30) | — | |
| SCHEMBL16613575 | 0.85 | PTGER1 (0.31) | — | |
| SCHEMBL16613645 | 0.85 | PDE4A (0.34) | — | |
| SCHEMBL16613480 | 0.85 | ALDH1A1 (0.30) | — |
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-2015047058-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2015-04-02 | — | — | WO | disclosed |