Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCA | P17252 | 11/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12643254 | 0.94 | CYP2C9 (0.35) | PRKCACYP2C9CYP2C19NPSR1MEN1 | |
| SCHEMBL13264195 | 0.86 | CYP19A1 (0.30) | — | |
| SCHEMBL11846570 | 0.79 | SIRT2 (0.35) | PRKCACYP2C9CYP2C19SIRT2 | |
| SCHEMBL4488798 | 0.76 | NR5A1 (0.31) | MEN1KMT2ATDP1 | |
| SCHEMBL4484737 | 0.75 | TSHR (0.33) | MEN1KMT2ATDP1 | |
| SCHEMBL8516656 | 0.74 | PRKCA (0.48) | PRKCACYP2C9CYP2C19NPSR1MEN1 | |
| Iodomethane SCHEMBL27882398 | 0.73 | — | — | |
| Chloromethane SCHEMBL27865997 | 0.73 | CES1 (0.32) | — | |
| Bromomethane SCHEMBL27882394 | 0.73 | — | — | |
| SCHEMBL9360186 | 0.72 | SIRT2 (0.40) | SIRT2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017116213-A1 | LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME | 주식회사 동진쎄미켐 | 2017-07-06 | — | — | WO | disclosed |
| WO-2017116213-A1 | LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME | 주식회사 동진쎄미켐 | 2017-07-06 | — | — | WO | disclosed |