Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | RPA1 | P27694 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAP2 | P11137 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21922960 | 0.97 | ESR1 (0.42) | ESR1ACHEHPGDESR2LMNA | |
| SCHEMBL21922948 | 0.94 | ESR1 (0.43) | ESR1ACHEHPGDESR2LMNA | |
| SCHEMBL21922964 | 0.92 | ESR1 (0.42) | ESR1ACHEHPGDCA2HDAC8 | |
| SCHEMBL21922670 | 0.88 | ESR1 (0.44) | ESR1ACHEHPGDCA2HDAC8 | |
| SCHEMBL21922654 | 0.88 | HSD17B1 (0.39) | ESR1HPGDESR2GPR84HDAC8 | |
| SCHEMBL21922671 | 0.87 | ESR1 (0.53) | ESR1ACHEHPGDESR2LMNA | |
| SCHEMBL30980792 | 0.86 | ACHE (0.37) | ESR1ACHEESR2LMNAMAPT | |
| SCHEMBL19002149 | 0.86 | ACHE (0.37) | ESR1ACHEESR2LMNAMAPT | |
| SCHEMBL18893073 | 0.86 | ACHE (0.37) | ESR1ACHEESR2LMNAMAPT | |
| SCHEMBL22019488 | 0.86 | ACHE (0.35) | ESR1ACHEESR2RPA1MCL1 |
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 |