Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21664792 | 0.78 | NPSR1 (0.36) | NPSR1SIGMAR1SLC2A1CHRM2HTR1A | |
| SCHEMBL23140180 | 0.77 | CYP1A2 (0.33) | — | |
| SCHEMBL3903877 | 0.77 | NPSR1 (0.41) | NPSR1SIGMAR1SLC2A1USP2PAOX | |
| SCHEMBL918207 | 0.77 | NPSR1 (0.50) | NPSR1SIGMAR1USP2PAOXLMNA | |
| SCHEMBL3903880 | 0.77 | NPSR1 (0.46) | NPSR1SIGMAR1SLC2A1USP2PAOX | |
| SCHEMBL1980876 | 0.77 | NPSR1 (0.41) | NPSR1SIGMAR1SLC2A1USP2PAOX | |
| Water SCHEMBL21295559 | 0.75 | NPSR1 (0.48) | NPSR1SIGMAR1USP2PAOXLMNA | |
| SCHEMBL15052279 | 0.75 | SIGMAR1 (0.48) | NPSR1SIGMAR1SLC2A1CHRM2HTR1A | |
| SCHEMBL235041 | 0.75 | SIGMAR1 (0.42) | NPSR1SIGMAR1SLC2A1CHRM2HTR1A | |
| SCHEMBL234338 | 0.75 | SIGMAR1 (0.48) | NPSR1SIGMAR1SLC2A1CHRM2HTR1A |
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-3301120-B1 | METHOD FOR PREPARING MODIFIED CONJUGATED DIENE-BASED POLYMER | LG CHEMICAL LTD (KR) | 2020-02-05 | — | — | EP | disclosed |