Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CPT2 | P23786 | 1/20 | 0.31 |
| ▸ | ACLY | P53396 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2900373 | 0.97 | — | — | |
| SCHEMBL324849 | 0.97 | — | — | |
| SCHEMBL27874503 | 0.97 | ALDH1A1 (0.42) | TP53ALDH1A1TSHRTET2CYP2D6 | |
| SCHEMBL28751474 | 0.94 | TP53 (0.40) | TP53ALDH1A1TSHRTET2CYP2D6 | |
| SCHEMBL27664140 | 0.94 | TP53 (0.40) | TP53ALDH1A1TSHRTET2CYP2D6 | |
| Lactic Acid SCHEMBL29065437 | 0.89 | TP53 (0.58) | TP53ALDH1A1TSHRTET2CYP2D6 | |
| SCHEMBL28552922 | 0.81 | TSHR (0.37) | TP53ALDH1A1TSHRTET2 | |
| SCHEMBL263616 | 0.75 | — | — | |
| SCHEMBL20266460 | 0.74 | — | — | |
| SCHEMBL11785494 | 0.71 | — | — |
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-100528827-C | Method for producing ester | JAPAN SCIENCE & TECH AGENCY (JP) | 2009-08-19 | — | — | CN | disclosed |
| CN-1874987-A | Method for producing ester condensed product | JAPAN SCIENCE & TECH AGENCY (JP) | 2006-12-06 | — | — | CN | disclosed |