Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 4/20 | 0.44 |
| ▸ | CES1 | P23141 | 4/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | PPARD | Q03181 | 4/20 | 0.41 |
| ▸ | PPARA | Q07869 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.41 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.41 |
| ▸ | TLR2 | O60603 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| 3-Octanone SCHEMBL28223375 | 0.84 | KMT2A (0.56) | KMT2AMAPTCES2CES1AKR1B1 | |
| 3-Octanone SCHEMBL8962351 | 0.84 | — | — | |
| 3-Octanone SCHEMBL1866763 | 0.84 | KMT2A (0.61) | KMT2AMAPTCES2CES1AKR1B1 | |
| 3-Octanone SCHEMBL5593 | 0.84 | — | — | |
| 3-Octanone SCHEMBL28179723 | 0.82 | CES2 (0.51) | KMT2AMAPTCES2CES1AKR1B1 | |
| 3-Octanone SCHEMBL28097534 | 0.82 | KMT2A (0.60) | KMT2AMAPTCES2CES1AKR1B1 | |
| SCHEMBL4361047 | 0.82 | KMT2A (0.65) | KMT2AMAPTCES2CES1HAO1 | |
| SCHEMBL1870779 | 0.82 | KMT2A (0.65) | KMT2AMAPTCES2CES1HAO1 | |
| SCHEMBL21044630 | 0.82 | KMT2A (0.65) | KMT2AMAPTCES2CES1HAO1 | |
| SCHEMBL3122593 | 0.82 | KMT2A (0.65) | KMT2AMAPTCES2CES1HAO1 |
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-109180843-A | The non-phthalic acid ester compound as electron donor for polyolefin catalyst | 美国台塑公司 | 2019-01-11 | — | — | CN | disclosed |
| CN-105339085-B | Non-phthalate compounds as electron donors for polyolefin catalysts | 美国台塑公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-105121433-B | Antiviral compound, its pharmaceutically acceptable salt or optical isomer, the method for preparing them and the pharmaceutical composition for being used to prevent or treat viral disease for containing the same as active ingredient | 韩国化学研究院 | 2018-01-23 | — | — | CN | disclosed |