Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | LSS | P48449 | 1/20 | 0.40 |
| ▸ | MAPK7 | Q13164 | 4/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL14965524 | 0.93 | CHRM1 (0.51) | CHRM1KCNH2HSD11B1PTGS1SLC6A2 | |
| SCHEMBL14966212 | 0.91 | HSD11B1 (0.44) | CHRM1KCNH2HSD11B1MGLLMAPK7 | |
| SCHEMBL14965586 | 0.88 | EPHX2 (0.51) | CHRM1KCNH2EPHX2 | |
| SCHEMBL14965608 | 0.86 | CHRM1 (0.48) | CHRM1KCNH2HSD11B1PTGS1SLC6A2 | |
| SCHEMBL14965621 | 0.84 | CHRM1 (0.44) | CHRM1KCNH2HSD11B1PTGS1SLC6A2 | |
| SCHEMBL14965637 | 0.83 | CHRM1 (0.51) | CHRM1KCNH2PTGS1SLC6A2SLC6A4 | |
| SCHEMBL14965946 | 0.81 | CYP1A2 (0.46) | MGLL | |
| SCHEMBL14965604 | 0.81 | THRB (0.34) | CHRM1KCNH2LMNASMN1; SMN2 | |
| SCHEMBL14965365 | 0.81 | CHRM1 (0.49) | CHRM1KCNH2PTGS1SLC6A2SLC6A4 | |
| SCHEMBL14965842 | 0.79 | CHRM1 (0.59) | 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 1 patent. 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 | disclosed |