Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 3/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 5/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512315 | 1.00 | ACACB (0.33) | ACACBARAAK1PAX8CCR5 | |
| SCHEMBL9509449 | 0.91 | CYP2C9 (0.41) | ACACBARAAK1PAX8CCR5 | |
| SCHEMBL9509015 | 0.91 | ACACB (0.38) | ACACB | |
| SCHEMBL9512392 | 0.89 | CYP2C9 (0.34) | ACACBARPAX8DRD2 | |
| SCHEMBL9510192 | 0.88 | CYP2C9 (0.34) | ACACBARPAX8DRD2 | |
| SCHEMBL9512338 | 0.87 | ACACB (0.34) | ACACB | |
| SCHEMBL9509344 | 0.87 | SPHK1 (0.34) | — | |
| SCHEMBL9511371 | 0.87 | SPHK1 (0.34) | — | |
| SCHEMBL9512291 | 0.86 | ESR2 (0.39) | AAK1PAX8 | |
| SCHEMBL12230852 | 0.86 | ESR2 (0.39) | AAK1PAX8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021134883-A1 | LIQUID CRYSTAL COMPOSITION OF NEGATIVE LIQUID CRYSTAL COMPOUND HAVING METHOXY BRIDGE BOND AND USE THEREOF | 北京八亿时空液晶科技股份有限公司 | 2021-07-08 | — | — | WO | disclosed |