Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 4/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CA12 | O43570 | 3/20 | 0.51 |
| ▸ | JAK2 | O60674 | 2/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 2/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 5/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CTSC | P53634 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22862590 | 0.82 | MIF (0.57) | MIFCA9CA1CA2CA12 | |
| SCHEMBL25043776 | 0.76 | JAK2 (0.45) | JAK2ROCK2GSK3BRXRAGRIN1 | |
| SCHEMBL25043786 | 0.75 | RXRA (0.38) | RXRAGRIN1GRIN2B | |
| SCHEMBL19063588 | 0.74 | MIF (0.52) | MIFCA9CA1CA2CA12 | |
| SCHEMBL14023943 | 0.74 | MIF (0.48) | MIFCA9CA1CA2CA12 | |
| SCHEMBL25045291 | 0.73 | KDM4E (0.40) | GSK3BRXRAGRIN1GRIN2B | |
| SCHEMBL21623941 | 0.73 | NOTUM (0.40) | RXRAGRIN1GRIN2B | |
| SCHEMBL25043784 | 0.73 | NOTUM (0.64) | CA9CA1CA2CA12 | |
| SCHEMBL30694014 | 0.73 | MIF (0.54) | MIFCA9CA1CA2CA12 | |
| Hydrochloric Acid SCHEMBL31583100 | 0.72 | MIF (0.52) | MIFCA9CA1CA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023016521-A1 | SUBSTITUTED TRIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF | 上海赛默罗生物科技有限公司 | 2023-02-16 | — | — | WO | disclosed |