Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12781919 | 0.83 | PDK2 (0.49) | ESR1ESR2PDK2TDP1 | |
| SCHEMBL27351313 | 0.83 | MAPT (0.53) | ESR1ESR2PDK2TDP1KDM4E | |
| SCHEMBL30931486 | 0.83 | PDK2 (0.49) | ESR1ESR2PDK2TDP1 | |
| SCHEMBL13353700 | 0.83 | TDP2 (0.37) | ESR1ESR2KDM4ELMNAMAPT | |
| SCHEMBL24424712 | 0.82 | PDK2 (0.44) | ESR1ESR2PDK2TDP1 | |
| SCHEMBL29582458 | 0.82 | PDK2 (0.44) | ESR1ESR2PDK2TDP1 | |
| SCHEMBL13665842 | 0.82 | PDK2 (0.38) | ESR1ESR2PDK2KDM4ELMNA | |
| SCHEMBL5505298 | 0.82 | ESR1 (0.40) | ESR1ESR2PDK2 | |
| SCHEMBL14580682 | 0.79 | ESR1 (0.39) | ESR1ESR2PDK2KDM4EMAPT | |
| SCHEMBL14580692 | 0.79 | CA1 (0.37) | ESR1ESR2PDK2KDM4ELMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118974002-A | Compound, material for organic electroluminescent element, and electronic device | 出光兴产株式会社 | 2024-11-15 | — | — | CN | claimed |
| WO-2024024591-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2024-02-01 | — | — | WO | claimed |
| CN-118974002-A | Compound, material for organic electroluminescent element, and electronic device | 出光兴产株式会社 | 2024-11-15 | — | — | CN | disclosed |
| WO-2024024591-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2024-02-01 | — | — | WO | disclosed |