Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22101140 | 0.90 | CYP3A4 (0.44) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL14479463 | 0.82 | ALDH1A1 (0.50) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL1614546 | 0.82 | ALDH1A1 (0.50) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL2024694 | 0.82 | CYP3A4 (0.75) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL17808449 | 0.80 | CYP3A4 (0.63) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL1615585 | 0.79 | ALDH1A1 (0.53) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL19262009 | 0.79 | CYP3A4 (0.71) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL30388209 | 0.79 | CYP3A4 (0.71) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL2018959 | 0.79 | CYP3A4 (0.71) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL4133589 | 0.79 | HPRT1 (0.45) | TDP1ALOX5JAK2PLA2G2APLA2G4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3667755-A1 | ORGANIC LIGHT EMITTING DEVICE, A METHOD FOR MANUFACTURING THE SAME AND A COMPOSITION FOR USE THEREIN | Novaled GmbH (DE) | 2020-06-17 | — | — | EP | disclosed |