Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL21922669 | 0.98 | ESR1 (0.52) | ESR1HPGDACHELMNAMAPT | |
| SCHEMBL21922968 | 0.98 | ESR1 (0.52) | ESR1HPGDACHELMNAMAPT | |
| SCHEMBL21922670 | 0.90 | ESR1 (0.44) | ESR1HPGDACHECA2 | |
| SCHEMBL21922948 | 0.88 | ESR1 (0.43) | ESR1HPGDACHELMNACA2 | |
| SCHEMBL18893041 | 0.88 | ACHE (0.42) | ESR1ACHELMNAMAPTHTT | |
| SCHEMBL21922964 | 0.87 | ESR1 (0.42) | ESR1HPGDACHECA2 | |
| SCHEMBL21922672 | 0.87 | ESR1 (0.44) | ESR1HPGDACHELMNAMAPT | |
| SCHEMBL18893005 | 0.86 | ACHE (0.41) | ESR1HPGDACHELMNAMAPT | |
| SCHEMBL18893075 | 0.86 | ACHE (0.41) | ESR1HPGDACHELMNAMAPT | |
| SCHEMBL20967392 | 0.86 | LMNA (0.44) | ESR1ACHELMNAMAPTHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3643720-B1 | ORGANIC COMPOUNDS, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC ELECTRONIC DEVICE | NOVALED GMBH (DE) | 2021-09-29 | — | — | EP | disclosed |
| EP-3643720-A1 | ORGANIC COMPOUNDS, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC ELECTRONIC DEVICE | Novaled GmbH (DE) | 2020-04-29 | — | — | EP | disclosed |