Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 6/20 | 0.35 |
| ▸ | KRAS | P01116 | 1/20 | 0.34 |
| ▸ | VCP | P55072 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL16613700 | 0.88 | ADORA2A (0.33) | MCL1KRASADORA2A | |
| SCHEMBL16613453 | 0.88 | VCP (0.35) | VCPADORA2A | |
| SCHEMBL16613726 | 0.86 | ADORA1 (0.41) | MCL1ADORA1ADORA2A | |
| SCHEMBL16613468 | 0.86 | VCP (0.34) | VCPADORA2A | |
| SCHEMBL16613264 | 0.86 | MCL1 (0.38) | MCL1 | |
| SCHEMBL16613529 | 0.85 | VCP (0.33) | VCP | |
| SCHEMBL16613544 | 0.84 | VCP (0.33) | VCP | |
| SCHEMBL16613487 | 0.84 | VCP (0.33) | VCP | |
| SCHEMBL16613419 | 0.84 | VCP (0.33) | VCP | |
| SCHEMBL16613545 | 0.84 | ADORA2A (0.36) | VCPADORA2A |
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 |