Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | GPR3 | P46089 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 2/20 | 0.30 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2053791 | 0.87 | HSD11B1 (0.35) | CHRM5PDE3BPDE3AHSD11B1IDO1 | |
| SCHEMBL2437985 | 0.81 | HSD11B1 (0.38) | HSD11B1TRPA1PDK2GPR3AR | |
| SCHEMBL17514845 | 0.81 | HSD11B1 (0.48) | HSD11B1TRPA1AR | |
| SCHEMBL17514962 | 0.78 | HSD11B1 (0.48) | HSD11B1TRPA1PDK2 | |
| SCHEMBL2050214 | 0.77 | PTPN1 (0.34) | HSD11B1PTPN1 | |
| SCHEMBL2049864 | 0.77 | S1PR2 (0.37) | PTPN1 | |
| SCHEMBL17514475 | 0.77 | — | — | |
| SCHEMBL2433532 | 0.76 | NR1H2 (0.35) | CYP11B2AR | |
| SCHEMBL3636361 | 0.75 | HSD11B1 (0.42) | HSD11B1TRPA1PDK2AR | |
| SCHEMBL2049471 | 0.75 | HSD11B1 (0.46) | PDE3BPDE3AHSD11B1TRPA1PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013182433-A1 | A PROCESS USING GRIGNARD REAGENTS | BASF SE (DE) | 2013-12-12 | — | — | WO | disclosed |
| EP-2547687-A1 | A PROCESS USING GRIGNARD REAGENTS | BASF SE (DE) | 2013-01-23 | — | — | EP | disclosed |
| EP-2513067-A1 | METHOD FOR PRODUCING TRIAZOLINTHIONE DERIVATIVES AND INTERMEDIATES THEREOF | BASF SE (DE) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011073145-A1 | METHOD FOR PRODUCING TRIAZOLINTHIONE DERIVATIVES AND INTERMEDIATES THEREOF | BASF SE (DE) | 2011-06-23 | — | — | WO | disclosed |