Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LPO | P22079 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL1682013 | 0.86 | ALDH1A1 (0.37) | CA1CA2CA9CA12TSHR | |
| SCHEMBL31245489 | 0.83 | MCL1 (0.39) | CA1CA2CA9CA12TSHR | |
| Sulfuric Acid SCHEMBL4250215 | 0.79 | LPO (0.41) | CA1CA2CA9CA12TSHR | |
| Sulfuric Acid SCHEMBL2995711 | 0.79 | LPO (0.41) | CA1CA2CA9CA12TSHR | |
| SCHEMBL3104611 | 0.79 | LPO (0.41) | CA1CA2CA9CA12TSHR | |
| Trifluoromethanesulfonamide SCHEMBL4578343 | 0.78 | FDPS (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL16694847 | 0.78 | — | — | |
| SCHEMBL15149 | 0.78 | — | — | |
| SCHEMBL27984281 | 0.78 | KDM4E (0.35) | CA1CA2CA9CA12TSHR | |
| SCHEMBL3000417 | 0.77 | CA12 (0.42) | CA1CA2CA9CA12LPO |
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 |
|---|---|---|---|---|---|---|---|
| US-6025457-A | POLYMERIZABLE IMIDAZOLIUM DERIVATIVE; HEAT RESISTANCE | SHIKOKU CHEMICALS CORPORATION (JP) | 2000-02-15 | — | — | US | disclosed |