Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19314647 | 0.83 | BDKRB2 (0.33) | — | |
| SCHEMBL25006752 | 0.75 | TAS1R3 (0.40) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| SCHEMBL931807 | 0.69 | NR1I2 (0.43) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| SCHEMBL25008403 | 0.68 | F2R (0.33) | SLC6A2SLC6A4ALDH1A1CTSK | |
| SCHEMBL27457534 | 0.68 | HTT (0.52) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| SCHEMBL9440242 | 0.68 | HTT (0.52) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| Hydrochloric Acid SCHEMBL30725888 | 0.68 | HTT (0.56) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| SCHEMBL27314198 | 0.67 | TAS1R3 (0.47) | TAS1R3TAS1R1HDAC3HDAC1HDAC2 | |
| SCHEMBL18078301 | 0.65 | TDP1 (0.66) | NQO2TAS1R3TAS1R1HDAC3HDAC1 | |
| SCHEMBL21596587 | 0.65 | TP53 (0.45) | NQO2PTGS1PTGS2HDAC3HDAC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4129402-A1 | HYDROXYPYRROLIDINE DERIVATIVE AND MEDICINAL APPLICATION THEREOF | Mitsubishi Tanabe Pharma Corporation (JP) | 2023-02-08 | — | — | EP | disclosed |