Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 5/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21723950 | 0.86 | CETP (0.45) | CETPTRPM8CHRM2CHRM1CHRM3 | |
| SCHEMBL21724485 | 0.85 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL21724517 | 0.85 | LSS (0.42) | TRPM8 | |
| SCHEMBL21723766 | 0.82 | ALDH1A1 (0.43) | CETP | |
| SCHEMBL21723869 | 0.81 | GRIN1 (0.37) | — | |
| SCHEMBL21723655 | 0.81 | CETP (0.42) | CETPTRPM8CNR1NR3C1KCNN4 | |
| SCHEMBL21723933 | 0.80 | MEN1 (0.46) | CHRM2CHRM3 | |
| SCHEMBL21723951 | 0.80 | PYCR1 (0.48) | ATM | |
| SCHEMBL21724535 | 0.78 | PYCR1 (0.46) | — | |
| SCHEMBL10852766 | 0.77 | RAB9A (0.46) | P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020035826-A1 | 1,2-DITHIOLONE COMPOUNDS AND USE THEREOF | PI INDUSTRIES LTD. (IN) | 2020-02-20 | — | — | WO | disclosed |