Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGA | O60502 | 4/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | HRH2 | P25021 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | HTR5A | P47898 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | IDH1 | O75874 | 5/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966122 | 0.90 | OGA (0.41) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965593 | 0.89 | MET (0.39) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965871 | 0.88 | ALDH1A1 (0.42) | OGAHTR6PKMMAPTALDH1A1 | |
| SCHEMBL14966207 | 0.87 | CHRM1 (0.37) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965573 | 0.87 | CHRM1 (0.50) | OGASLC6A2HRH4HRH3IDH1 | |
| SCHEMBL14965636 | 0.83 | HRH4 (0.47) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965923 | 0.82 | OGA (0.46) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965841 | 0.82 | OGA (0.46) | OGAADRA2BADRA2CSLC6A2HRH2 | |
| SCHEMBL14965984 | 0.80 | MAPT (0.42) | ACHEMAPTALDH1A1TDP1L3MBTL1 | |
| SCHEMBL14965617 | 0.80 | TRPV1 (0.45) | OGAALDH1A1 |
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 |