Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.37 |
| ▸ | PLAU | P00749 | 2/20 | 0.37 |
| ▸ | F12 | P00748 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25569972 | 0.83 | CYP3A4 (0.54) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL25672111 | 0.83 | CYP3A4 (0.54) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL30062535 | 0.80 | HSD17B10 (0.52) | CYP3A4MAPK1CYP2A6NQO1NQO2 | |
| SCHEMBL13250616 | 0.80 | HSD17B10 (0.52) | CYP3A4MAPK1CYP2A6NQO1NQO2 | |
| SCHEMBL24057785 | 0.80 | GPR3 (0.46) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL28838096 | 0.79 | CYP3A4 (0.61) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL29836842 | 0.79 | CYP3A4 (0.61) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL23972147 | 0.78 | KDM4E (0.47) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL25547960 | 0.77 | MAPT (0.40) | CYP3A4MAPK1LMNAMAPTAPEX1 | |
| SCHEMBL24758926 | 0.75 | CYP2A6 (0.50) | MAPK1LMNACYP2A6NQO1NQO2 |
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-2023096459-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-06-01 | — | — | WO | disclosed |