Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.35 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.35 |
| ▸ | PTPRB | P23467 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | STS | P08842 | 1/20 | 0.34 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28834318 | 0.81 | KCNQ4 (0.41) | RXFP1LMNAPOLBMETAP1KCNQ4 | |
| SCHEMBL437388 | 0.80 | LCK (0.45) | CYP17A1CA1CA2 | |
| SCHEMBL1352029 | 0.80 | RAF1 (0.48) | CYP17A1CA1CA2 | |
| SCHEMBL10965342 | 0.79 | MAPT (0.48) | GPR35MAPTCA1CA2 | |
| SCHEMBL28834313 | 0.78 | GAA (0.39) | METAP1CYP17A1CA1CA2 | |
| SCHEMBL6640279 | 0.78 | CYP17A1 (0.36) | METAP1KCNQ4KCNQ5CYP17A1CA1 | |
| SCHEMBL27620314 | 0.77 | MAPT (0.43) | METAP1CYP17A1MAPTCA1CA2 | |
| SCHEMBL438824 | 0.76 | CYP17A1 (0.35) | METAP1KCNQ4KCNQ5CYP17A1CA1 | |
| SCHEMBL25360784 | 0.75 | EGLN2 (0.41) | TRPA1KCNQ4KCNQ5CYP17A1CA1 | |
| SCHEMBL8574413 | 0.74 | MAPT (0.57) | RXFP1LMNAGPR35TRPA1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112939829-B | Synthetic method of aryl trifluoromethyl thioether | 武汉药明康德新药开发有限公司 | 2023-02-21 | — | — | CN | disclosed |
| CN-112939829-A | Synthetic method of aryl trifluoromethyl thioether | 武汉药明康德新药开发有限公司 | 2021-06-11 | — | — | CN | disclosed |