Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965407 | 0.97 | KCNJ1 (0.42) | KCNJ1ALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL14971065 | 0.91 | SLC2A1 (0.41) | KCNJ1ALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL14965511 | 0.91 | LTA4H (0.40) | ALDH1A1SMN1; SMN2LMNAMAPTNPSR1 | |
| SCHEMBL14965626 | 0.91 | LTA4H (0.40) | ALDH1A1SMN1; SMN2LMNAMAPTNPSR1 | |
| SCHEMBL14971108 | 0.90 | ALDH1A1 (0.44) | KCNJ1ALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL14965949 | 0.89 | HPGD (0.51) | ALDH1A1SMN1; SMN2PKMNPSR1MEN1 | |
| SCHEMBL14965948 | 0.88 | HPGD (0.50) | KCNJ1ALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL14966317 | 0.88 | LOXL2 (0.42) | ALDH1A1SMN1; SMN2CHEK1MEN1KMT2A | |
| SCHEMBL14966204 | 0.87 | SLC2A1 (0.42) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL14965922 | 0.87 | MAPT (0.46) | KCNJ1ALDH1A1SMN1; SMN2LMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | claimed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |