Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 12/20 | 0.59 |
| ▸ | CA2 | P00918 | 12/20 | 0.59 |
| ▸ | CA12 | O43570 | 10/20 | 0.59 |
| ▸ | CA9 | Q16790 | 10/20 | 0.59 |
| ▸ | CA4 | P22748 | 7/20 | 0.59 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21587286 | 0.84 | CA1 (0.62) | CA1CA2CA12CA9CA4 | |
| SCHEMBL18360504 | 0.83 | CA1 (0.58) | CA1CA2CA12CA9CA4 | |
| SCHEMBL16906829 | 0.83 | CA1 (0.61) | CA1CA2CA12CA9CA4 | |
| SCHEMBL19582095 | 0.83 | CA1 (0.65) | CA1CA2CA12CA9CA4 | |
| SCHEMBL23542758 | 0.82 | CA1 (0.44) | CA1CA2CA12CA9CA4 | |
| SCHEMBL24121287 | 0.82 | CA1 (0.68) | CA1CA2CA12CA9CA4 | |
| SCHEMBL30616853 | 0.82 | CA1 (0.59) | CA1CA2CA12CA9CA4 | |
| SCHEMBL30616854 | 0.82 | CA1 (0.59) | CA1CA2CA12CA9CA4 | |
| Hydrochloric Acid SCHEMBL22031644 | 0.81 | CA1 (0.66) | CA1CA2CA12CA9CA4 | |
| SCHEMBL30616855 | 0.81 | CA1 (0.58) | CA1CA2CA12CA9CA4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3578562-B1 | L-VALINATE AMIDE BENZOXABOROLE DERIVATIVES FOR THE TREATMENT OF PARASITIC DISEASES | ANACOR PHARMACEUTICALS INC (US) | 2021-06-23 | — | — | EP | disclosed |
| EP-3578562-A1 | L-VALINATE AMIDE BENZOXABOROLE DERIVATIVES FOR THE TREATMENT OF PARASITIC DISEASES | Anacor Pharmaceuticals, Inc (US) | 2019-12-11 | — | — | EP | disclosed |
| WO-2017195069-A1 | OXABOROLE ESTERS AND USES THEREOF | ANACOR PHARMACEUTICALS, INC. (US) | 2017-11-16 | — | — | WO | disclosed |