Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8773078 | 0.91 | CA12 (0.39) | CA12CA1CA9STAT3GAA | |
| SCHEMBL9673433 | 0.89 | CA12 (0.38) | CA12CA1CA9STAT3GAA | |
| SCHEMBL9673806 | 0.88 | CA12 (0.38) | CA12CA1CA9STAT3GAA | |
| SCHEMBL28172956 | 0.81 | CA12 (0.43) | CA12CA1CA9STAT3GAA | |
| SCHEMBL241884 | 0.80 | CA1 (0.52) | CA12CA1CA9STAT3GAA | |
| SCHEMBL26545325 | 0.79 | CA12 (0.40) | CA12CA1CA9STAT3GAA | |
| SCHEMBL13456779 | 0.79 | CA12 (0.41) | CA12CA1CA9STAT3GAA | |
| SCHEMBL26545311 | 0.79 | CA1 (0.41) | CA12CA1CA9STAT3GAA | |
| SCHEMBL8856851 | 0.78 | GAA (0.45) | CA12CA1CA9STAT3GAA | |
| SCHEMBL483847 | 0.77 | ALDH1A1 (0.50) | CA12CA1CA9STAT3GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105829316-B | Tetrahydro-tetrazolo [1,5-a] pyrazine as ROR gamma inhibitors | 默克专利股份公司 | 2019-01-08 | — | — | CN | claimed |
| CN-105829316-A | Tetrahydro-tetrazolo[1,5-a]pyrazines as ROR-gamma inhibitors | 默克专利股份公司 | 2016-08-03 | — | — | CN | claimed |
| CN-105829316-B | Tetrahydro-tetrazolo [1,5-a] pyrazine as ROR gamma inhibitors | 默克专利股份公司 | 2019-01-08 | — | — | CN | disclosed |
| CN-105829316-A | Tetrahydro-tetrazolo[1,5-a]pyrazines as ROR-gamma inhibitors | 默克专利股份公司 | 2016-08-03 | — | — | CN | disclosed |