Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 6/20 | 0.36 |
| ▸ | AR | P10275 | 4/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | ACP1 | P24666 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL22562595 | 0.97 | ACP1 (0.35) | SCN9AARPDK2ACP1GABRA1 | |
| SCHEMBL22562620 | 0.95 | SCN9A (0.35) | SCN9AARPDK2ACP1GABRA1 | |
| SCHEMBL22562487 | 0.93 | SCN9A (0.36) | SCN9AARPDK2ACP1GABRA1 | |
| SCHEMBL22562604 | 0.92 | ACP1 (0.35) | SCN9AARPDK2ACP1GABRA1 | |
| SCHEMBL22562318 | 0.92 | GABRG2 (0.39) | SCN9AARGABRA1GABRG2GABRB3 | |
| SCHEMBL22562223 | 0.92 | ALDH1A3 (0.37) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL22562310 | 0.91 | ALDH1A3 (0.42) | SCN9APDK2ACP1GABRA1GABRG2 | |
| SCHEMBL22562411 | 0.91 | ACP1 (0.39) | SCN9APDK2ACP1KDM4EALDH1A1 | |
| SCHEMBL22562311 | 0.90 | KIF11 (0.42) | SCN9APDK2ACP1GABRA1GABRG2 | |
| SCHEMBL21546751 | 0.89 | ALDH1A3 (0.40) | SCN9APDK2ACP1GABRA1GABRG2 |
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-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |