Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 4/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | NMT1 | P30419 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.34 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.34 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.34 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.34 |
| ▸ | CACNG7 | P62955 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 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 | |
|---|---|---|---|---|
| SCHEMBL14966014 | 0.92 | CHRNA7 (0.42) | FAAHCHRNA7CD274ALDH1A1CLK4 | |
| SCHEMBL14971091 | 0.86 | DRD2 (0.44) | FAAHKDM4EALDH1A1DRD2DRD4 | |
| SCHEMBL14966205 | 0.83 | LSS (0.46) | KDM4EALDH1A1TDP1DRD2DRD4 | |
| SCHEMBL14966131 | 0.83 | DRD2 (0.49) | KDM4EALDH1A1TDP1DRD2DRD4 | |
| SCHEMBL14971085 | 0.82 | TNIK (0.40) | FAAHDRD4FGFR1FGFR2FGFR3 | |
| SCHEMBL14965795 | 0.82 | CYP11B1 (0.45) | NMT1DRD2DRD4DRD3HTR1A | |
| SCHEMBL14966240 | 0.82 | KIT (0.40) | DRD2DRD4DRD3 | |
| SCHEMBL14969448 | 0.81 | MEN1 (0.41) | FAAHKDM4EALDH1A1TDP1DRD2 | |
| SCHEMBL14966336 | 0.81 | DRD2 (0.45) | FAAHDRD2DRD4DRD3HTR1A | |
| SCHEMBL14966085 | 0.80 | FAAH (0.46) | FAAHNMT1KDM4EALDH1A1 |
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 |