Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.50 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.50 |
| ▸ | CPA1 | P15085 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 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 | |
|---|---|---|---|---|
| SCHEMBL5936817 | 0.84 | GRIK1 (0.47) | GRIK1GRIK2CPA1CYP2C19TBXAS1 | |
| SCHEMBL7703172 | 0.82 | GRIK1 (0.40) | GRIK1GRIK2CPA1 | |
| Ethylene SCHEMBL28464372 | 0.80 | CHRM1 (0.35) | GRIK1GRIK2CPA1 | |
| SCHEMBL19825149 | 0.79 | CHRM1 (0.38) | CPA1 | |
| SCHEMBL891727 | 0.79 | GRIK1 (0.64) | GRIK1GRIK2CPA1CYP2C19TBXAS1 | |
| SCHEMBL28056911 | 0.79 | — | — | |
| SCHEMBL6050002 | 0.77 | GRIK1 (0.75) | GRIK1GRIK2CPA1CYP2C19TBXAS1 | |
| SCHEMBL24179433 | 0.76 | CPA1 (0.35) | GRIK1GRIK2CPA1 | |
| SCHEMBL9503286 | 0.76 | — | — | |
| Trifluoroacetic Acid SCHEMBL16974631 | 0.75 | GRIK1 (0.46) | GRIK1GRIK2CPA1CYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020039769-A1 | Process for preparing optically active 3,3,3- trifluoromethyl-2-alkylpropionic acid derivatives | LONZA AG | 2002-04-04 | — | — | US | claimed |
| US-6599721-B2 | Chemical intermediates; hydrolysis using hydrolases | LONZA AG (CH) | 2003-07-29 | — | — | US | disclosed |
| US-6599721-B2 | Chemical intermediates; hydrolysis using hydrolases | LONZA AG (CH) | 2003-07-29 | — | — | US | disclosed |
| US-20020039769-A1 | Process for preparing optically active 3,3,3- trifluoromethyl-2-alkylpropionic acid derivatives | LONZA AG | 2002-04-04 | — | — | US | disclosed |
| US-20020039769-A1 | Process for preparing optically active 3,3,3- trifluoromethyl-2-alkylpropionic acid derivatives | LONZA AG | 2002-04-04 | — | — | US | disclosed |
| US-20020039769-A1 | Process for preparing optically active 3,3,3- trifluoromethyl-2-alkylpropionic acid derivatives | LONZA AG | 2002-04-04 | — | — | US | disclosed |