Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.36 |
| ▸ | CHRNG | P07510 | 1/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHRND | Q07001 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL16770967 | 0.67 | SLC6A2 (0.41) | CCR2TSHRSLC6A2SLC6A3CHRNA1 | |
| SCHEMBL8210195 | 0.67 | TSHR (0.42) | CCR2TSHRSLC6A2SLC6A3CHRNA1 | |
| SCHEMBL28197918 | 0.65 | TSHR (0.40) | CCR2TSHRSLC6A2SLC6A3CHRNA1 | |
| 1,3,5-Trichlorobenzene SCHEMBL429512 | 0.63 | — | — | |
| SCHEMBL16591245 | 0.62 | SLC6A3 (0.37) | TSHRSLC6A2SLC6A3CHRNA1CHRNG | |
| SCHEMBL19399638 | 0.62 | TSHR (0.42) | TSHRSLC6A2SLC6A3SLC6A4TP53 | |
| SCHEMBL16884630 | 0.61 | SLC6A2 (0.47) | SLC6A2SLC6A3CHRNA1CHRNGCHRNB1 | |
| SCHEMBL20550175 | 0.61 | — | — | |
| 1,3,5-Trichlorobenzene SCHEMBL27517345 | 0.61 | TSHR (0.73) | TSHRTP53CYP3A4 | |
| SCHEMBL17299186 | 0.61 | OPRM1 (0.36) | SLC6A2SLC6A3CHRNA1CHRNGCHRNB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107529748-A | Molecule with desinsection effectiveness, and relative intermediate, composition and method | 美国陶氏益农公司 | 2018-01-02 | — | — | CN | disclosed |