Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | PTPRZ1 | P23471 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
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 SCHEMBL4643970 | 0.99 | GPR3 (0.35) | GPR3CA2CA12CA1CA9 | |
| Trifluoromethanesulfonic Acid SCHEMBL4643441 | 0.90 | CA2 (0.42) | GPR3CA2CA12CA1CA9 | |
| Trifluoromethanesulfonic Acid SCHEMBL4647330 | 0.88 | KCNH2 (0.33) | GPR3KCNH2 | |
| Trifluoromethanesulfonic Acid SCHEMBL4644616 | 0.88 | KCNH2 (0.44) | GPR3CA2CA1CA9KCNH2 | |
| SCHEMBL4641390 | 0.87 | CA1 (0.34) | CA2CA12CA1CA9CA14 | |
| Trifluoromethanesulfonic Acid SCHEMBL4643720 | 0.87 | GPR3 (0.38) | GPR3CA2CA12CA1CA9 | |
| SCHEMBL4642255 | 0.86 | CA1 (0.35) | CA2CA12CA1CA9CA14 | |
| Trifluoromethanesulfonic Acid SCHEMBL4641793 | 0.85 | KCNH2 (0.33) | GPR3KCNH2 | |
| Trifluoromethanesulfonic Acid SCHEMBL4644622 | 0.85 | KCNH2 (0.34) | GPR3KCNH2 | |
| Trifluoromethanesulfonic Acid SCHEMBL4643549 | 0.83 | SOS1 (0.37) | GPR3CA2CA1CA9LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1443042-B1 | HYBRID ONIUM SALT | WAKO PURE CHEM IND LTD (JP) | 2008-08-13 | — | — | EP | disclosed |
| US-7101918-B2 | Hybrid type onium salt | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 2006-09-05 | — | — | US | disclosed |
| US-20050020710-A1 | Hybrid onium salt | WAKO PURE CHEMICALS INDUSTRIES, LTD. (JP) | 2005-01-27 | — | — | US | disclosed |
| EP-1443042-A1 | HYBRID ONIUM SALT | Wako Pure Chemical Industries, Ltd. (JP) | 2004-08-04 | — | — | EP | disclosed |