Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 5/20 | 0.38 |
| ▸ | HTR1A | P08908 | 4/20 | 0.38 |
| ▸ | HTR1B | P28222 | 4/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 3/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL3688422 | 0.79 | CA1 (0.44) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL29279337 | 0.79 | CXCR2 (0.45) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL8501949 | 0.78 | CA1 (0.53) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL9470326 | 0.75 | ALDH1A1 (0.47) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL8632562 | 0.75 | MAPK1 (0.34) | HSD11B1CA1CA2EPAS1 | |
| SCHEMBL3824427 | 0.74 | KIF11 (0.43) | CA1CA2ALDH1A1 | |
| SCHEMBL8778353 | 0.73 | CA1 (0.40) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL3125396 | 0.73 | SMN1; SMN2 (0.42) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL4056753 | 0.73 | CA1 (0.51) | HSD11B1CA1CA2HTR1DHTR1A | |
| SCHEMBL6935409 | 0.72 | CA12 (0.55) | CA1CA2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8245566-A | — | — | None | — | — | JP | disclosed |
| JP-H08245566-A | NEW SULFONIUM SALT | SHIN ETSU CHEM CO LTD | 1996-09-24 | — | — | JP | disclosed |