Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | RORB | Q92753 | 3/20 | 0.38 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25569970 | 0.75 | MAPT (0.39) | MAPK14MAPK13MAPK12MAPK11ADORA2A | |
| SCHEMBL17523406 | 0.75 | PTGS2 (0.42) | ADORA2AADORA1ARNPC1RAB9A | |
| SCHEMBL17351685 | 0.75 | PTGS2 (0.42) | ADORA2AADORA1ARNPC1RAB9A | |
| SCHEMBL25547959 | 0.74 | NPC1 (0.41) | ARNPC1RAB9A | |
| SCHEMBL25548018 | 0.74 | ADORA2A (0.38) | MAPK14ADORA2AADORA1IDO1CYP19A1 | |
| Hydrogen Sulfide SCHEMBL25548012 | 0.72 | RORB (0.42) | MAPK14MAPK13MAPK12MAPK11ADORA2A | |
| SCHEMBL4928287 | 0.70 | IDO1 (0.44) | MAPK14ADORA2AADORA1IDO1RORB | |
| SCHEMBL26021644 | 0.70 | PLA2G7 (0.43) | NPC1RAB9A | |
| SCHEMBL25548089 | 0.69 | AR (0.44) | ADORA2AADORA1IDO1AR | |
| SCHEMBL29136280 | 0.68 | IDO1 (0.43) | MAPK14MAPK13MAPK12MAPK11ADORA2A |
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-2023096465-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-06-01 | — | — | WO | disclosed |