Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 2/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.53 |
| ▸ | HTR3A | P46098 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NAAA | Q02083 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20170447 | 1.00 | CHRM1 (0.53) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL20170459 | 1.00 | CHRM1 (0.53) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL19115356 | 0.98 | CHRM1 (0.54) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL7217444 | 0.93 | CHRM1 (0.59) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL3908224 | 0.90 | CA2 (0.54) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL5827222 | 0.89 | EPHX1 (0.52) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| Ammonia Solution, Strong SCHEMBL11651733 | 0.89 | CA2 (0.53) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL7223238 | 0.87 | NAAA (0.56) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL14875486 | 0.87 | EPHX1 (0.48) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 | |
| SCHEMBL22086821 | 0.86 | EPHX1 (0.42) | CHRM1CHRM3ADRA1ACHRM2CHRNA4 |
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-106905802-B | Antifouling coating composition and coated article having coating film thereof | 关西涂料株式会社 | 2021-06-25 | — | — | CN | disclosed |
| US-6667285-B1 | Branched-chain carboxylic acid monoalkyl ester with outstanding hydrolytic stability | NEW JAPAN CHEMICAL CO., LTD. (JP) | 2003-12-23 | — | — | US | disclosed |
| EP-1225213-A1 | LUBRICATING OIL FOR REFRIGERATOR, HYDRAULIC FLUID COMPOSITION FOR REFRIGERATOR AND METHOD FOR LUBRICATION OF REFRIGERATOR | NEW JAPAN CHEMICAL CO.,LTD. (JP) | 2002-07-24 | — | — | EP | disclosed |