Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | TEK | Q02763 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 5/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL16624873 | 0.87 | KCNH2 (0.42) | KCNH2CA12CA1CA2CA9 | |
| SCHEMBL18011979 | 0.87 | KCNH2 (0.62) | KCNH2CA12CA1CA2CA9 | |
| SCHEMBL16624985 | 0.85 | KCNH2 (0.56) | KCNH2CA12CA1CA2CA9 | |
| SCHEMBL16624950 | 0.84 | KCNH2 (0.42) | KCNH2CA12CA1CA2CA9 | |
| SCHEMBL16624945 | 0.81 | FLT3 (0.49) | KCNH2PTGS1SLC6A2SLC6A4RXRA | |
| SCHEMBL18031082 | 0.77 | KCNH2 (0.70) | KCNH2KEAP1NFE2L2PTGS1SLC6A2 | |
| SCHEMBL16618234 | 0.77 | KCNH2 (0.60) | KCNH2CA12CA9KEAP1NFE2L2 | |
| SCHEMBL16618336 | 0.74 | KCNH2 (0.58) | KCNH2CA12CA9KEAP1NFE2L2 | |
| SCHEMBL18031081 | 0.74 | KCNH2 (0.63) | KCNH2CA12CA1CA2CA9 | |
| SCHEMBL16618270 | 0.72 | KCNH2 (0.78) | KCNH2CA12CA1CA2CA9 |
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-2015049693-A1 | 6-NITRO-2,3-DIHYDROIMIDAZO[2,1-b]OXAZOLES AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-04-09 | — | — | WO | disclosed |