Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICMT | O60725 | 3/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 3/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24186494 | 0.86 | BACE1 (0.39) | ICMTBACE1HDAC6HTR2AHTR2C | |
| SCHEMBL14625577 | 0.78 | PTGDR (0.37) | MAP3K14BACE1HDAC6POLBHTR2A | |
| SCHEMBL28555007 | 0.74 | HDAC4 (0.39) | ICMTBACE1PGRALDH1A1 | |
| SCHEMBL29924296 | 0.74 | PTGDR (0.47) | PGRSLC6A4SLC6A3 | |
| SCHEMBL17186742 | 0.71 | MAP3K14 (0.41) | MAP3K14BACE1HDAC6PDE2APDE10A | |
| SCHEMBL24685578 | 0.71 | HTR2C (0.41) | HTR2AHTR2CHTR2BSRD5A1SLC6A4 | |
| SCHEMBL18717556 | 0.71 | BACE1 (0.41) | MAP3K14BACE1HDAC6PDE2APDE10A | |
| SCHEMBL17543307 | 0.71 | ATM (0.36) | MAP3K14BACE1POLBSLC6A4SLC6A3 | |
| SCHEMBL17543131 | 0.71 | ATM (0.39) | MAP3K14BACE1POLBALDH1A1 | |
| SCHEMBL13229767 | 0.71 | SLC6A4 (0.39) | MAP3K14BACE1HDAC6HTR2AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117177970-A | Polycyclic derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-12-05 | — | — | CN | disclosed |
| 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 |