Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28505856 | 0.98 | CSNK1E (0.41) | CSNK1ECNR2OPRM1OPRD1OPRK1 | |
| SCHEMBL28507149 | 0.98 | CSNK1E (0.41) | CSNK1ECNR2OPRM1OPRD1OPRK1 | |
| SCHEMBL28604372 | 0.81 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2A | |
| SCHEMBL3975233 | 0.81 | CSNK1E (0.40) | CSNK1ECNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL28286948 | 0.81 | CSNK1E (0.40) | CSNK1ECNR2OPRM1OPRD1OPRK1 | |
| SCHEMBL28920060 | 0.80 | — | — | |
| SCHEMBL28286954 | 0.79 | CSNK1E (0.42) | CSNK1ECNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL28435067 | 0.79 | CSNK1E (0.42) | CSNK1ECNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL28285563 | 0.79 | CSNK1E (0.42) | CSNK1ECNR2ALDH1A1MEN1KMT2A | |
| SCHEMBL28496430 | 0.78 | LMNA (0.37) | — |
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-109503645-B | Chiral gem-disilyl alkane compound containing four silicon-hydrogen bonds and synthesis method and application thereof | 浙江大学 | 2021-08-03 | — | — | CN | disclosed |
| CN-109111333-B | Chiral gem-disilyl alkane compound and synthesis method and application thereof | 浙江大学 | 2021-01-08 | — | — | CN | disclosed |