Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29924989 | 1.00 | HTT (0.39) | HTTNPSR1POLBSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL30275355 | 0.88 | HTT (0.38) | HTTNPSR1POLBSMN1; SMN2LMNA | |
| SCHEMBL29424063 | 0.78 | MAPT (0.46) | HTTNPSR1POLBLMNAALDH1A1 | |
| SCHEMBL24186579 | 0.78 | ADRB1 (0.48) | HTTNPSR1SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL29149759 | 0.78 | PTGS1 (0.35) | HTTTSHRL3MBTL1MCL1GAA | |
| SCHEMBL29924595 | 0.78 | PTGS1 (0.35) | HTTTSHRL3MBTL1MCL1GAA | |
| SCHEMBL29924327 | 0.78 | PTGS1 (0.35) | HTTTSHRL3MBTL1MCL1GAA | |
| SCHEMBL29149833 | 0.78 | PTGS1 (0.35) | HTTTSHRL3MBTL1MCL1GAA | |
| SCHEMBL30983767 | 0.75 | LTA4H (0.37) | HTTNPSR1POLBSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL30416305 | 0.74 | LTA4H (0.50) | LTA4H |
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-2022228490-A1 | POLYCYCLIC DERIVATIVE MODULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2022-11-03 | — | — | WO | disclosed |