Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965709 | 0.89 | CHRM1 (0.46) | CHRM1KCNH2EPHX2PTGS1SLC6A2 | |
| SCHEMBL14965728 | 0.88 | EPHX2 (0.47) | CHRM1EPHX2FAAH | |
| SCHEMBL14965836 | 0.83 | MCHR1 (0.41) | CHRM1KCNH2EPHX2PTGS1SLC6A2 | |
| SCHEMBL14965608 | 0.82 | CHRM1 (0.48) | CHRM1KCNH2EPHX2PTGS1SLC6A2 | |
| SCHEMBL14965755 | 0.81 | EPHX2 (0.50) | CHRM1KCNH2EPHX2PTGS1SLC6A2 | |
| SCHEMBL14966094 | 0.80 | PDE7A (0.33) | CHRM1SIGMAR1 | |
| SCHEMBL14971162 | 0.78 | DRD2 (0.38) | CHRM1 | |
| SCHEMBL14965548 | 0.77 | CHRM1 (0.52) | CHRM1KCNH2PTGS1SLC6A2SLC6A4 | |
| SCHEMBL14965842 | 0.76 | CHRM1 (0.59) | CHRM1KCNH2PTGS1SLC6A2SLC6A4 | |
| SCHEMBL14965622 | 0.75 | CHRM1 (0.50) | CHRM1KCNH2PTGS1SLC6A2SLC6A4 |
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 2 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 |