Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | FPR2 | P25090 | 3/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | LIPE | Q05469 | 1/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | ME2 | P23368 | 1/20 | 0.42 |
| ▸ | ME1 | P48163 | 1/20 | 0.42 |
| ▸ | ME3 | Q16798 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22605809 | 0.85 | IDO1 (0.47) | LMNAALDH1A1GAAPKMHRH3 | |
| SCHEMBL31285853 | 0.85 | IDO1 (0.47) | LMNAALDH1A1GAAPKMHRH3 | |
| SCHEMBL22605506 | 0.81 | EGFR (0.45) | LMNAALDH1A1GAAHRH3HSD11B1 | |
| SCHEMBL22605739 | 0.79 | CTSS (0.55) | HRH3HSD11B1LIPEME2ME1 | |
| SCHEMBL30317157 | 0.77 | HSD11B1 (0.73) | LMNAALDH1A1HSD11B1TNKSPARP1 | |
| SCHEMBL22594434 | 0.77 | HSD11B1 (0.73) | LMNAALDH1A1HSD11B1TNKSPARP1 | |
| SCHEMBL22605671 | 0.76 | HSD11B1 (0.48) | HRH3HSD11B1LIPEME2ME1 | |
| SCHEMBL22588034 | 0.76 | HSD11B1 (0.57) | LMNAALDH1A1HRH3HSD11B1LIPE | |
| SCHEMBL31285953 | 0.75 | CNR1 (0.46) | PKMHRH3LIPEME2ME1 | |
| SCHEMBL22605627 | 0.75 | HSD11B1 (0.50) | LMNAHRH3HSD11B1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020216378-A1 | HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME | 健艾仕生物医药有限公司 | 2020-10-29 | — | — | WO | disclosed |