Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.34 |
| ▸ | CA1 | P00915 | 5/20 | 0.34 |
| ▸ | CA2 | P00918 | 5/20 | 0.34 |
| ▸ | CA9 | Q16790 | 5/20 | 0.34 |
| ▸ | CA7 | P43166 | 4/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.34 |
| ▸ | CA6 | P23280 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27841352 | 0.77 | ALKBH5 (0.36) | ALDH1A1TSHRCES2MYC | |
| SCHEMBL9694318 | 0.72 | BCHE (0.40) | SCDPOLB | |
| SCHEMBL21274660 | 0.69 | OXER1 (0.42) | CA12CA1CA2CA9CA7 | |
| SCHEMBL2703082 | 0.68 | MAPT (0.38) | CA12CA9ALDH1A1TSHRIDH1 | |
| SCHEMBL10059741 | 0.68 | SMN1; SMN2 (0.60) | ALDH1A1IDH1ESR1ESR2SCD | |
| SCHEMBL13677546 | 0.64 | POLB (0.46) | POLB | |
| SCHEMBL28534220 | 0.64 | POLB (0.33) | ALDH1A1ESR1MYCPOLBHSD17B10 | |
| SCHEMBL27585075 | 0.64 | HSD17B13 (0.37) | CA12CA9ALDH1A1TSHRHSD17B10 | |
| SCHEMBL28249694 | 0.64 | — | — | |
| SCHEMBL21625233 | 0.62 | CYP3A4 (0.38) | TSHRESR1MAOAESR2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110028445-A | A kind of process using carbon dioxide production 3- Ethyl formate -4- hydroxyl -2- pyridone | 南开大学 | 2019-07-19 | — | — | CN | claimed |
| CN-110028445-B | Process method for producing 3-ethyl formate-4-hydroxy-2-pyridone by using carbon dioxide | 南开大学 | 2022-04-12 | — | — | CN | disclosed |
| CN-110028445-A | A kind of process using carbon dioxide production 3- Ethyl formate -4- hydroxyl -2- pyridone | 南开大学 | 2019-07-19 | — | — | CN | disclosed |
| CN-110028445-A | A kind of process using carbon dioxide production 3- Ethyl formate -4- hydroxyl -2- pyridone | 南开大学 | 2019-07-19 | — | — | CN | disclosed |
| CN-110028445-A | A kind of process using carbon dioxide production 3- Ethyl formate -4- hydroxyl -2- pyridone | 南开大学 | 2019-07-19 | — | — | CN | disclosed |