Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.42 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.39 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL940383 | 0.98 | ADRA1A (0.44) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL9118868 | 0.93 | ADRA1A (0.41) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL21274454 | 0.93 | ADRA1A (0.41) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL14359807 | 0.87 | CACNA2D1 (0.43) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL1335604 | 0.87 | ADRA1A (0.48) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL967149 | 0.87 | ADRA1A (0.48) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL28391062 | 0.86 | ALDH1A1 (0.52) | TDP1GPR84CA2MAPK1CYP3A4 | |
| SCHEMBL11294180 | 0.85 | ADRA1A (0.46) | ADRA1AHDAC1HDAC2TDP1CHRM1 | |
| SCHEMBL27860703 | 0.85 | GPR84 (0.57) | TDP1GPR84CA2MAPK1CYP3A4 | |
| SCHEMBL276400 | 0.84 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119371582-A | Polybutadiene composite rubber and preparation method thereof, rubber composition and application thereof | 中国石油化工股份有限公司 | 2025-01-28 | — | — | CN | claimed |
| CN-108929396-B | Rare earth metal catalyst system and method for preparing high cis conjugated diene polymer | 北京化工大学 | 2020-07-28 | — | — | CN | claimed |
| CN-119371582-A | Polybutadiene composite rubber and preparation method thereof, rubber composition and application thereof | 中国石油化工股份有限公司 | 2025-01-28 | — | — | CN | disclosed |
| CN-108929396-B | Rare earth metal catalyst system and method for preparing high cis conjugated diene polymer | 北京化工大学 | 2020-07-28 | — | — | CN | disclosed |
| CN-108250371-B | Bonding type polymer/silicon dioxide hybrid material and preparation method thereof | 北京化工大学 | 2020-06-02 | — | — | CN | disclosed |
| CN-108250327-B | Functionalized polymer containing silicon and hydroxyl at chain end, preparation method thereof and branched polymer | 北京化工大学 | 2020-04-14 | — | — | CN | disclosed |