Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3817615 | 0.92 | ACHE (0.45) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| Bromide SCHEMBL2834644 | 0.90 | ACHE (0.47) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| Hydrochloric Acid SCHEMBL1895160 | 0.90 | KMT2A (0.47) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| SCHEMBL2834160 | 0.82 | BCHE (0.41) | ACHEBCHE | |
| Trifluoromethanesulfonic Acid SCHEMBL2834864 | 0.79 | ACHE (0.35) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| Hydrochloric Acid SCHEMBL2207971 | 0.78 | KMT2A (0.53) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| Hydrochloric Acid SCHEMBL2207483 | 0.76 | KMT2A (0.50) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| SCHEMBL1072280 | 0.74 | ACHE (0.54) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| SCHEMBL4895571 | 0.74 | ACHE (0.55) | ACHECHRM2ADRA2AADORA3CHRM1 | |
| SCHEMBL1996136 | 0.72 | BCHE (0.48) | ACHEBCHE |
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-107694609-A | A kind of catalyst and method of methanol liquid-phase oxidative carbonylation Synthesis of dimethyl carbonate | 中国科学院成都有机化学有限公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-107532129-A | Efficient small volume nucleic acid synthesis | 生命技术公司 | 2018-01-02 | — | — | CN | disclosed |
| US-20100048327-A1 | Highly-Neutralized Golf Ball Compositions | ACUSHNET COMPANY | 2010-02-25 | — | — | US | disclosed |