Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | CA4 | P22748 | 1/20 | 0.60 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 3/20 | 0.31 |
| ▸ | NOS1 | P29475 | 3/20 | 0.31 |
| ▸ | NOS2 | P35228 | 3/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL11963791 | 0.95 | CA1 (0.54) | CA1CA2CA4PABPC1APOBEC3A | |
| SCHEMBL11591596 | 0.87 | CA1 (0.67) | CA1CA2CA4CYP1A2ADRA2A | |
| SCHEMBL13766711 | 0.85 | CA1 (0.60) | CA1CA2CA4PABPC1APOBEC3A | |
| SCHEMBL29065439 | 0.84 | CA1 (0.64) | CA1CA2CA4CYP1A2ADRA2A | |
| SCHEMBL14873017 | 0.81 | CA1 (0.56) | CA1CA2CA4CYP1A2ADRA2A | |
| SCHEMBL17063633 | 0.81 | CA1 (0.59) | CA1CA2CA4CYP1A2ADRA2A | |
| SCHEMBL130805 | 0.81 | TDP1 (0.50) | CA1CA2CA4PABPC1APOBEC3A | |
| SCHEMBL33424 | 0.81 | TDP1 (0.50) | CA1CA2CA4PABPC1APOBEC3A | |
| SCHEMBL130804 | 0.81 | TDP1 (0.50) | CA1CA2CA4PABPC1APOBEC3A | |
| SCHEMBL44781 | 0.81 | TDP1 (0.50) | CA1CA2CA4PABPC1APOBEC3A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117720932-A | Negative liquid crystal compound, liquid crystal composition and application thereof | 安徽宇贝新材料科技有限公司 | 2024-03-19 | — | — | CN | disclosed |
| CN-116496794-A | Thiophene-containing liquid crystal compound, liquid crystal composition containing the same, and liquid crystal display device | 石家庄诚志永华显示材料有限公司 | 2023-07-28 | — | — | CN | disclosed |
| WO-2007001283-A2 | CHEMICAL SYNTHESIS OF LOW MOLECULAR WEIGHT POLYGLUCOSAMINES AND POLYGALACTOSAMINES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2007-01-04 | — | — | WO | disclosed |