Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 5/20 | 0.39 |
| ▸ | AR | P10275 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | LDHB | P07195 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL14290259 | 0.80 | CYP1A2 (0.38) | KDM4EALDH1A1GAAHPGDMEN1 | |
| SCHEMBL28995326 | 0.80 | AR (0.38) | SLC22A12ARHSD11B1CUL4APTGS2 | |
| SCHEMBL28918930 | 0.79 | P2RX7 (0.39) | SLC22A12ARKDM4EALDH1A1GLA | |
| SCHEMBL29115306 | 0.79 | AR (0.34) | ARP2RX7HSD11B1L3MBTL1CUL4A | |
| SCHEMBL21192823 | 0.76 | P2RX7 (0.41) | SLC22A12ARP2RX7LDHALDHB | |
| SCHEMBL10976334 | 0.76 | P2RX7 (0.37) | SLC22A12ARKDM4EP2RX7LDHA | |
| SCHEMBL29115282 | 0.72 | GLA (0.35) | ARALDH1A1GLAGAA | |
| SCHEMBL10354613 | 0.72 | TSHR (0.43) | KDM4EALDH1A1GAAHPGDMEN1 | |
| SCHEMBL1275083 | 0.72 | SLC22A12 (0.55) | SLC22A12ARKDM4EALDH1A1GLA | |
| SCHEMBL33745024 | 0.71 | P2RX7 (0.38) | ALDH1A1P2RX7TYK2HSD11B1L3MBTL1 |
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-115703728-A | Trifluoromethyl phenyl thiocyanate compound | 上海泰初化工技术有限公司 | 2023-02-17 | — | — | CN | disclosed |