Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL894093 | 0.87 | — | — | |
| SCHEMBL5685864 | 0.84 | CYP1A2 (0.61) | CYP1A2CA1CA9NOS3NOS1 | |
| SCHEMBL23120175 | 0.79 | CYP1A2 (0.42) | CYP1A2CA1CA9CHRM5NAAA | |
| SCHEMBL25192351 | 0.78 | CYP1A2 (0.78) | CYP1A2NAAA | |
| SCHEMBL28598751 | 0.76 | — | — | |
| SCHEMBL9616911 | 0.76 | — | — | |
| SCHEMBL8226932 | 0.76 | — | — | |
| SCHEMBL18268934 | 0.74 | — | — | |
| SCHEMBL522959 | 0.74 | — | — | |
| SCHEMBL17161100 | 0.72 | CYP1A2 (0.34) | CYP1A2CA1CA9CHRM5CHRM2 |
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-110452212-B | Preparation method of 11-undecalactone compound and caprolactone compound | 浙江大学 | 2020-08-14 | — | — | CN | disclosed |
| CN-110452212-A | A kind of preparation method of 11- undecalactone class compound and caprolactone class compound | UNIV ZHEJIANG | 2019-11-15 | — | — | CN | disclosed |
| US-20080312112-A1 | Lubricating formulations for dispersancy and temperature, friction, and wear reduction | LYON DEVELOPMENT CORPORATION | 2008-12-18 | — | — | US | disclosed |