Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL5828491 | 0.85 | GPR3 (0.43) | GPR3FAAHPRSS1PRSS2ELANE | |
| Trifluoromethanesulfonic Acid SCHEMBL7863371 | 0.84 | KCNH2 (0.45) | GPR3KCNH2ACHE | |
| Trifluoromethanesulfonic Acid SCHEMBL7864830 | 0.84 | GPR3 (0.42) | GPR3FAAHPRSS1PRSS2ELANE | |
| Sulfuric Acid SCHEMBL9457320 | 0.84 | CA2 (0.41) | FAAHPRSS1PRSS2ELANEPRTN3 | |
| Sulfuric Acid SCHEMBL3297014 | 0.82 | TSHR (0.44) | FAAHPRSS1PRSS2ELANEPRTN3 | |
| Trifluoromethanesulfonic Acid SCHEMBL1741788 | 0.81 | GPR3 (0.40) | GPR3FAAHPRSS1PRSS2ELANE | |
| Trifluoromethanesulfonic Acid SCHEMBL19692248 | 0.77 | GPR3 (0.46) | GPR3FAAHPRSS1PRSS2ELANE | |
| SCHEMBL247179 | 0.76 | CALM1 (0.50) | CES1EPHX2CES2 | |
| Trifluoromethanesulfonic Acid SCHEMBL30851370 | 0.74 | KDM4E (0.44) | GPR3FAAHPRSS1PRSS2ELANE | |
| Trifluoromethanesulfonic Acid SCHEMBL1130292 | 0.74 | KDM4E (0.59) | GPR3FAAHPRSS1PRSS2ELANE |
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-8208597-A | — | — | None | — | — | JP | disclosed |
| JP-H08208597-A | BENZYLSULFONIUM TRIFLUOROMETHANESULFONIC ACID SALT | SHIN ETSU CHEM CO LTD | 1996-08-13 | — | — | JP | disclosed |