Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 4/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | NT5E | P21589 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18952921 | 1.00 | CHRNB4 (0.50) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL9098055 | 0.85 | HSP90AA1 (0.54) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL9097312 | 0.81 | HSP90AA1 (0.65) | CHRNB4CHRNA3HSP90AA1NT5EALDH1A1 | |
| SCHEMBL9097323 | 0.81 | HSP90AA1 (0.65) | CHRNB4CHRNA3HSP90AA1NT5EALDH1A1 | |
| SCHEMBL9100934 | 0.80 | HSP90AA1 (0.52) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL11726479 | 0.79 | CHRNB2 (0.43) | CHRNB2CHRNA4CYP2D6 | |
| SCHEMBL22609007 | 0.79 | CHRNB4 (0.55) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL20576024 | 0.77 | HSP90AA1 (0.43) | CHRNB4CHRNA3HSP90AA1NT5EALDH1A1 | |
| SCHEMBL20576027 | 0.77 | HSP90AA1 (0.43) | CHRNB4CHRNA3HSP90AA1NT5EALDH1A1 | |
| SCHEMBL9099227 | 0.77 | HSP90AA1 (0.46) | CHRNB4CHRNA3HSP90AA1NT5EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3386982-A1 | 7-OXO-6-(SULFOOXY)-1,6-DIAZABICYCLO[3.2.1]OCTANE-2-CARBOXAMIDE CONTAINING COMPOUNDS AND THEIR USE IN TREATING BACTERIAL INFECTIONS | The Wockhardt Limited (IN) | 2018-10-17 | — | — | EP | disclosed |
| WO-2017098425-A1 | 7-OXO-6-(SULFOOXY)-1,6-DIAZABICYCLO[3.2.1]OCTANE-2-CARBOXAMIDE CONTAINING COMPOUNDS AND THEIR USE IN TREATING BACTERIAL INFECTIONS | WOCKHARDT LIMITED (IN) | 2017-06-15 | — | — | WO | disclosed |