Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 5/20 | 0.45 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.45 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.45 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25101942 | 0.91 | ESR1 (0.50) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL11941256 | 0.91 | ESR1 (0.49) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL16749876 | 0.87 | ESR1 (0.58) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL19818255 | 0.87 | ESR1 (0.48) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL13784034 | 0.86 | ESR1 (0.50) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL9976957 | 0.86 | ESR1 (0.53) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL21157486 | 0.86 | ESR1 (0.46) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL23654617 | 0.86 | MAPK10 (0.48) | ESR1ESR2MAPK10GRIA1CACNG8 | |
| SCHEMBL14225726 | 0.86 | ESR1 (0.55) | ESR1ESR2MEN1KMT2AHSP90AA1 | |
| SCHEMBL19628215 | 0.85 | ESR1 (0.54) | ESR1ESR2MEN1KMT2AHSP90AA1 |
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-3336077-B1 | AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2019-09-11 | — | — | EP | disclosed |
| EP-3336077-A2 | AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | LG Chem, Ltd. (KR) | 2018-06-20 | — | — | EP | disclosed |