Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16748703 | 0.90 | DAGLA (0.34) | TP53KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL9915358 | 0.88 | S1PR3 (0.37) | TP53S1PR3XDHPTPN11WDR5 | |
| SCHEMBL9915354 | 0.79 | TP53 (0.33) | TP53S1PR3PDE4BPDE4D | |
| SCHEMBL16748687 | 0.79 | HPGD (0.43) | CNR2NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL9915503 | 0.78 | TP53 (0.39) | TP53S1PR3XDHPTPN11KDM4E | |
| SCHEMBL17040094 | 0.77 | HDAC1 (0.46) | CNR2PTPN11KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16747529 | 0.77 | XDH (0.41) | TP53XDHCNR2WDR5ALDH1A1 | |
| SCHEMBL17244012 | 0.74 | S1PR1 (0.41) | XDHPTPN11 | |
| SCHEMBL2874377 | 0.74 | CYP1A2 (0.46) | CNR2PTPN11KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16748641 | 0.74 | GAA (0.43) | TP53S1PR3XDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-2646436-B1 | MONOBACTAMS | PFIZER (US) | 2015-05-27 | — | — | EP | disclosed |