Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 9/20 | 0.46 |
| ▸ | CA12 | O43570 | 5/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7924259 | 0.86 | F2 (0.49) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL13981195 | 0.84 | CA1 (0.66) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL3827068 | 0.82 | CYP1A2 (0.58) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL30754377 | 0.81 | CA1 (0.63) | CA9CA1CA2TSHRTDP1 | |
| SCHEMBL2471746 | 0.80 | LMNA (0.54) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL28854350 | 0.79 | CA9 (0.62) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL23887319 | 0.79 | DHFR (0.53) | CA9CA12CA1CA2TSHR | |
| SCHEMBL30307520 | 0.79 | DHFR (0.53) | CA9CA12CA1CA2TSHR | |
| SCHEMBL2998319 | 0.78 | CA9 (0.45) | CA9CA12F2PRSS1PRSS2 | |
| SCHEMBL27476835 | 0.78 | CA1 (0.47) | CA9CA1CA2TSHRDHFR |
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-102264226-B | Bicyclooctane-1, the 3-derovatives of phenyl-replacement | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-12-16 | — | — | CN | disclosed |