Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL22562587 | 0.92 | ALDH1A3 (0.39) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL22562209 | 0.91 | ALDH1A3 (0.42) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL19909397 | 0.91 | MYC (0.40) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL22562435 | 0.89 | TGFBR1 (0.37) | GRM5 | |
| SCHEMBL22562438 | 0.89 | ALDH1A3 (0.47) | ALDH1A3ADORA2AADORA1GRM5KDM4E | |
| SCHEMBL22562271 | 0.89 | MYC (0.42) | ALDH1A3ADORA2AMYCKDM4EGABRA1 | |
| SCHEMBL22562576 | 0.89 | PTGER4 (0.35) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL21279099 | 0.89 | MEN1 (0.38) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL22563480 | 0.88 | ALDH1A3 (0.38) | ALDH1A3ADORA2AADORA1GRM5MYC | |
| SCHEMBL22562260 | 0.88 | ALDH1A3 (0.40) | ALDH1A3ADORA2AMYCKDM4EMAPT |
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 |