Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MPI | P34949 | 1/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29370611 | 0.96 | ESR1 (0.47) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL7900283 | 0.96 | ESR1 (0.47) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL7651425 | 0.87 | ALDH1A1 (0.55) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL2725777 | 0.84 | MEN1 (0.52) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL7900253 | 0.84 | GPR84 (0.43) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL5497892 | 0.83 | SOS1 (0.41) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL18858078 | 0.81 | MAPK11 (0.43) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL16445344 | 0.81 | ESR1 (0.42) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL26756017 | 0.81 | HDAC4 (0.45) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL30394271 | 0.80 | ESR1 (0.63) | ESR1ESR2ALDH1A1KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-6203933-B1 | ELECTROLUMINESCENT ELEMENT WITH LIGHT EMITTER LAYER AND HOLE INJECTING AND TRANSPORTATING COMPOUND | TDK CORPORATION (JP) | 2001-03-20 | — | — | US | disclosed |