Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | F11 | P03951 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL21546667 | 0.92 | PGR (0.37) | BRD4F11CYP1A2CYP3A4CLK4 | |
| SCHEMBL21546662 | 0.92 | AR (0.41) | ELANEBRD4F11CYP1A2CYP3A4 | |
| SCHEMBL21546587 | 0.92 | ELANE (0.39) | ELANEBRD4F11CYP1A2CYP3A4 | |
| SCHEMBL21546848 | 0.90 | ELANE (0.38) | ELANEBRD4F11CYP1A2CYP3A4 | |
| SCHEMBL21547069 | 0.90 | ADRA2C (0.38) | BRD4CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL22760967 | 0.89 | ALDH1A3 (0.39) | BRD4CYP1A2CYP3A4ADRA2CCLK4 | |
| SCHEMBL21546601 | 0.89 | ELANE (0.38) | ELANEBRD4F11CYP1A2CYP3A4 | |
| SCHEMBL21546851 | 0.89 | ELANE (0.38) | ELANEBRD4F11CYP1A2CYP3A4 | |
| SCHEMBL21546675 | 0.88 | ELANE (0.38) | ELANEF11CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21546677 | 0.88 | ALDH1A3 (0.37) | ELANEBRD4CYP1A2CYP3A4CYP2D6 |
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 |