Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21517441 | 1.00 | AHR (0.41) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL21517552 | 0.95 | AHR (0.42) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL21517359 | 0.95 | AHR (0.42) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL24027778 | 0.92 | PDK2 (0.40) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL29869118 | 0.92 | PDK2 (0.43) | AHRPDK2MAPK1OPRM1OPRD1 | |
| SCHEMBL30913036 | 0.91 | AHR (0.42) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL15713385 | 0.89 | AHR (0.52) | AHRPDK2OPRM1OPRD1DRD2 | |
| SCHEMBL23285069 | 0.89 | PDK2 (0.47) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL22891353 | 0.89 | MAPK1 (0.45) | AHRPDK2MAPK1AKR1A1AKR1B1 | |
| SCHEMBL31753805 | 0.89 | MAPK1 (0.45) | AHRPDK2MAPK1AKR1A1AKR1B1 |
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-2019172699-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2019-09-12 | — | — | WO | disclosed |