Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.41 |
| ▸ | CA12 | O43570 | 6/20 | 0.41 |
| ▸ | CA1 | P00915 | 6/20 | 0.41 |
| ▸ | CA9 | Q16790 | 6/20 | 0.41 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3809038 | 0.87 | GAA (0.47) | CA2CA12CA1CA9AKR1C3 | |
| SCHEMBL3796213 | 0.85 | CA12 (0.48) | CA2CA12CA1CA9SMN1; SMN2 | |
| SCHEMBL3795965 | 0.85 | NHERF1 (0.46) | CA2CA12CA1CA9SMN1; SMN2 | |
| SCHEMBL3798133 | 0.85 | EPHX2 (0.50) | AKR1C3EPHX2 | |
| SCHEMBL3798068 | 0.85 | CA12 (0.53) | CA2CA12CA1CA9MMP8 | |
| SCHEMBL3798330 | 0.84 | GAA (0.43) | CA2CA12CA1CA9KDM4E | |
| SCHEMBL3791834 | 0.84 | CA12 (0.53) | CA2CA12CA1CA9AKR1C3 | |
| SCHEMBL27324944 | 0.83 | MMP8 (0.50) | CA2CA12CA1CA9SMN1; SMN2 | |
| SCHEMBL3802853 | 0.82 | ALDH1A1 (0.41) | CA2CA12CA1CA9ALDH1A1 | |
| SCHEMBL3792227 | 0.82 | PTGS2 (0.52) | CA2CA12CA1CA9 |
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-1662507-A | Pyrazole-3-one derivative, method for preparing the same, and pharmaceutical composition containing the same | CJ CORP (KR) | 2005-08-31 | — | — | CN | disclosed |