Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 2/20 | 0.36 |
| ▸ | MLNR | O43193 | 4/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965746 | 0.89 | DRD2 (0.41) | DRD2DRD4DRD3PDE4BMEN1 | |
| SCHEMBL14965683 | 0.88 | DRD2 (0.43) | DRD2DRD4DRD3PDE4BMEN1 | |
| SCHEMBL14966131 | 0.88 | DRD2 (0.49) | DRD2DRD4DRD3PDE4BMEN1 | |
| SCHEMBL14965866 | 0.85 | DRD2 (0.42) | DRD2DRD4DRD3MEN1KMT2A | |
| SCHEMBL14965805 | 0.85 | DHODH (0.36) | CYP11B1STAT3MCHR1METCHRM1 | |
| SCHEMBL14965730 | 0.85 | DRD2 (0.37) | DRD2DRD4DRD3PDE4BMEN1 | |
| SCHEMBL14965410 | 0.84 | DRD2 (0.38) | DRD2DRD4DRD3MEN1KMT2A | |
| SCHEMBL14965932 | 0.84 | HIF1A (0.41) | STAT3CHRM1 | |
| SCHEMBL14965820 | 0.82 | JAK2 (0.37) | STAT3METMEN1KMT2AALDH1A1 | |
| SCHEMBL14965652 | 0.82 | GPR119 (0.38) | CYP11B1MLNRMCHR1MET |
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 |