Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6157266 | 0.85 | ALDH1A1 (0.39) | ALDH1A1NPSR1POLBCYP1A2CYP2C9 | |
| SCHEMBL6155099 | 0.84 | MAPT (0.38) | ALDH1A1NPSR1KMT2AGAAMAPT | |
| SCHEMBL6154454 | 0.84 | POLB (0.41) | ALDH1A1SMN1; SMN2NPSR1POLBCYP1A2 | |
| SCHEMBL6157244 | 0.82 | ALDH1A1 (0.36) | ALDH1A1NPSR1POLBCYP1A2CYP2C9 | |
| SCHEMBL6154515 | 0.81 | POLB (0.37) | ALDH1A1NPSR1POLBCYP1A2CYP2C9 | |
| SCHEMBL6156140 | 0.81 | CASP1 (0.43) | ALDH1A1SMN1; SMN2NPSR1POLBCYP1A2 | |
| SCHEMBL140993 | 0.80 | KMT2A (0.43) | ALDH1A1SMN1; SMN2POLBCYP1A2CYP2C9 | |
| SCHEMBL6155396 | 0.80 | TSHR (0.39) | ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL6238994 | 0.80 | HPGD (0.42) | ALDH1A1KMT2AGAAMAPT | |
| SCHEMBL28060735 | 0.76 | CYP1A2 (0.51) | ALDH1A1POLBCYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0970947-B1 | PROCESS FOR PRODUCING BUTYRIC ESTER DERIVATIVES | KANEKA CORP (JP) | 2005-01-26 | — | — | EP | disclosed |
| US-6140527-A | Process for producing butyric ester derivatives | KANEKA CORPORATION (JP) | 2000-10-31 | — | — | US | disclosed |
| EP-0970947-A1 | PROCESS FOR PRODUCING BUTYRIC ESTER DERIVATIVES | KANEKA CORPORATION (JP) | 2000-01-12 | — | — | EP | disclosed |