Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | GPR3 | P46089 | 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 | |
|---|---|---|---|---|
| SCHEMBL11172344 | 0.87 | CA2 (0.33) | CA2CA1CA5ACA9PTPN1 | |
| SCHEMBL2483806 | 0.85 | HSD11B1 (0.33) | CA2CA1CA5ACA9 | |
| SCHEMBL36178 | 0.80 | CA2 (0.36) | CA2CA1CA5ACA9PTPN1 | |
| SCHEMBL10504323 | 0.77 | CA2 (0.32) | CA2CA1CA5ACA9 | |
| SCHEMBL503265 | 0.73 | PKM (0.34) | CA2CA1CA5ACA9 | |
| SCHEMBL9421930 | 0.73 | CA1 (0.32) | CA2CA1CA5ACA9 | |
| SCHEMBL9421902 | 0.73 | CA1 (0.32) | CA2CA1CA5ACA9 | |
| SCHEMBL1270050 | 0.69 | HSD11B1 (0.39) | CA2CA1CA5ACA9 | |
| SCHEMBL9421984 | 0.69 | BACE1 (0.35) | — | |
| SCHEMBL361657 | 0.69 | KMT2A (0.40) | CA2CA1CA9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55162763-A | — | — | None | — | — | JP | disclosed |
| US-7981318-B2 | Reaction reagent for trifluoromethylation | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 2011-07-19 | — | — | US | disclosed |
| US-20100230633-A1 | Reaction Reagent for Trifluoromethylation | TOSOH F-TECH, INC. (JP) | 2010-09-16 | — | — | US | disclosed |
| EP-2080744-A1 | REACTION REAGENT FOR TRIFLUOROMETHYLATION | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 2009-07-22 | — | — | EP | disclosed |
| US-4371710-A | CEPHALOSPORINS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1983-02-01 | — | — | US | disclosed |
| US-4324741-A | PERFLUOROALKYL GROUP-INTRODUCING AGENTS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1982-04-13 | — | — | US | disclosed |
| JP-S55162763-A | PERFLUOROALKYL COMPOUND AND ITS PREPARATION | SAGAMI CHEM RES CENTER | 1980-12-18 | — | — | JP | disclosed |