Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | ACACA | Q13085 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 5/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Dimebutic Acid SCHEMBL47533 | 0.97 | — | — | |
| Dimebutic Acid SCHEMBL20139427 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL1961089 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL28444780 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL1055427 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL25275531 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL1176300 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL1962006 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL8383027 | 0.94 | — | — | |
| Dimebutic Acid SCHEMBL28334807 | 0.94 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103772308-B | (preparation method of 1-ethyl-1-methyl-propyl) isoxazole intermediate is with the preparation method of Yi Evil grass amine for 5-amino-3- | BEIJING NUTRICHEM COMPANY LIMITED (CN) | 2015-11-18 | — | — | CN | disclosed |
| CN-103772308-A | Preparation method of 5-amino-3-(1-ethyl-1-methyl propyl) isoxazole midbody and preparation method of isoxaben | NUTRICHEM CO LTD | 2014-05-07 | — | — | CN | disclosed |