Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.32 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL4030876 | 0.76 | CA3 (0.31) | CA9ALDH1A1CA3CA6CA5A | |
| SCHEMBL1153218 | 0.76 | ESR1 (0.39) | KDM4ECA9CA1CA2CA7 | |
| SCHEMBL382451 | 0.71 | NPC1 (0.35) | PARP1ALDH1A1LMNAPOLBMAPT | |
| SCHEMBL6345650 | 0.71 | PARP1 (0.33) | PARP1CES1PDE3BPDE3A | |
| SCHEMBL17423913 | 0.71 | HSP90AA1 (0.39) | CA9CA1CA2CA7CES2 | |
| SCHEMBL3226561 | 0.71 | S100A4 (0.39) | PARP1DAOCES1ALDH1A1LMNA | |
| SCHEMBL7220827 | 0.71 | — | — | |
| Water SCHEMBL11162060 | 0.70 | NPC1 (0.34) | PARP1ALDH1A1LMNAPOLBMAPT | |
| 5-Fluoroisatin SCHEMBL28674168 | 0.69 | MAPK10 (0.43) | KDM4ECA9CA1CA2CA7 | |
| SCHEMBL1152547 | 0.68 | CA1 (0.42) | KDM4ECA9CA1CA2CA7 |
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-2010015037-A1 | THERAPEUTIC METHODS AND COMPOSITIONS | HOWARD FLOREY INSTITUTE (AU) | 2010-02-11 | — | — | WO | disclosed |