Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 2/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | ARG2 | P78540 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL17818233 | 1.00 | CYP4F2 (0.35) | CYP4F2CYP4A11ACLYARG2ATR | |
| SCHEMBL12100629 | 0.78 | SLC6A2 (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL2022509 | 0.78 | SLC6A2 (0.34) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17080490 | 0.77 | SLC6A2 (0.36) | SLC6A2MMP12MMP13 | |
| SCHEMBL17260435 | 0.77 | SLC6A2 (0.36) | SLC6A2MMP12MMP13 | |
| Hydrochloric Acid SCHEMBL18953979 | 0.75 | SLC6A2 (0.36) | SLC6A2MMP12MMP13 | |
| SCHEMBL17818301 | 0.73 | ACLY (0.37) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL17818345 | 0.73 | ACLY (0.37) | ACLYSLC6A2MMP12MMP13 | |
| SCHEMBL1236141 | 0.73 | CYP4F2 (0.39) | CYP4F2CYP4A11ACLYARG2GPR84 | |
| SCHEMBL2020872 | 0.73 | TSHR (0.35) | ACLYSLC6A2MMP12MMP13 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107001295-B | Isoxazole hydroxamic acid compounds as LpxC inhibitors | 诺华股份有限公司 | 2021-02-02 | — | — | CN | disclosed |