Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 15/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 15/20 | 0.50 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9556566 | 0.86 | CYP11B1 (0.45) | CYP11B1CYP11B2TRPV4GRM5MTOR | |
| SCHEMBL10432697 | 0.86 | CYP11B1 (0.45) | CYP11B1CYP11B2TRPV4GRM5MTOR | |
| SCHEMBL10502319 | 0.86 | CYP11B1 (0.45) | CYP11B1CYP11B2TRPV4GRM5MTOR | |
| SCHEMBL9556571 | 0.86 | CYP11B1 (0.45) | CYP11B1CYP11B2TRPV4GRM5MTOR | |
| SCHEMBL10502810 | 0.84 | CYP11B1 (0.45) | CYP11B1CYP11B2TRPV4FASN | |
| SCHEMBL28643620 | 0.84 | CYP11B1 (0.62) | CYP11B1CYP11B2TRPV4FASN | |
| SCHEMBL9556388 | 0.83 | CYP11B1 (0.43) | CYP11B1CYP11B2TRPV4GRM5FASN | |
| SCHEMBL9556391 | 0.83 | CYP11B1 (0.43) | CYP11B1CYP11B2TRPV4GRM5FASN | |
| SCHEMBL21237810 | 0.83 | CYP11B1 (0.63) | CYP11B1CYP11B2TRPV4 | |
| SCHEMBL10349591 | 0.82 | CYP11B1 (0.43) | CYP11B1CYP11B2TRPV4FASN |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2894148-B1 | NOVEL SMECTIC PHASE A LIQUID CRYSTAL MATERIAL | HALATION PHOTONICS CORP (CN) | 2019-04-03 | — | — | EP | disclosed |
| EP-0154840-B1 | LIQUID CRYSTAL COMPOUNDS | MERCK PATENT GmbH (DE) | 1989-01-25 | — | — | EP | disclosed |
| US-4704227-A | DERIVATIVES OF 1,3-DIOXANE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1987-11-03 | — | — | US | disclosed |
| EP-0154840-A2 | Liquid crystal compounds | MERCK PATENT GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |