Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27536324 | 0.82 | CA2 (0.45) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL27259330 | 0.81 | FOLH1 (0.33) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL27550458 | 0.81 | GPR84 (0.34) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Vinyl Chloride SCHEMBL28116046 | 0.79 | ALDH1A1 (0.32) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Ethane SCHEMBL27259007 | 0.79 | FOLH1 (0.32) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Ethylene SCHEMBL27551620 | 0.79 | TDP1 (0.36) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Hydrogen Peroxide SCHEMBL27786199 | 0.78 | — | — | |
| SCHEMBL157028 | 0.78 | — | — | |
| SCHEMBL28758744 | 0.78 | TSHR (0.33) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL27276142 | 0.77 | TSHR (0.35) | — |
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-110049806-A | Steam stripped method is carried out to the dispersion of organic extender particle | 陶氏环球技术有限责任公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-105531260-B | Oxime ester photoinitiator | 巴斯夫欧洲公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-104271549-B | It is a kind of new to prepare vitamin B6Midbody compound | 帝斯曼知识产权资产管理有限公司 | 2017-07-04 | — | — | CN | disclosed |