Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22761034 | 0.98 | AR (0.41) | ARPTGER4ADRA2CBRD4CYP1A2 | |
| SCHEMBL21546859 | 0.94 | AR (0.40) | ARPTGER4ADRA2CBRD4CYP1A2 | |
| SCHEMBL21546955 | 0.94 | AR (0.40) | ARADRA2CBRD4CYP1A2CYP3A4 | |
| SCHEMBL21546957 | 0.92 | AR (0.41) | ARADRA2CBRD4CYP1A2CYP3A4 | |
| SCHEMBL22760893 | 0.91 | ALDH1A3 (0.39) | PTGER4ADRA2CCYP1A2CYP3A4MEN1 | |
| SCHEMBL22760660 | 0.90 | TRPA1 (0.39) | PTGER4ADRA2CCYP1A2CYP3A4MEN1 | |
| SCHEMBL21546672 | 0.90 | AR (0.42) | ARADRA2CBRD4CYP1A2CYP3A4 | |
| SCHEMBL22760922 | 0.90 | PTGER4 (0.36) | ARPTGER4ADRA2CBRD4CYP1A2 | |
| SCHEMBL26776770 | 0.90 | AR (0.40) | ARPTGER4TGFBR1 | |
| SCHEMBL22760911 | 0.89 | ALDH1A3 (0.40) | ADRA2CCYP1A2CYP3A4MEN1ALDH1A1 |
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-3478793-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-11-06 | — | — | EP | disclosed |