Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL7679984 | 0.82 | ALOX15 (0.45) | CYP1A2ALDH1A1CYP2D6ALOX15LMNA | |
| SCHEMBL27560608 | 0.82 | EPHX1 (0.36) | CYP1A2EPHX1ALDH1A1NPSR1LMNA | |
| Acrylic Acid SCHEMBL8441153 | 0.79 | LMNA (0.48) | CYP1A2EPHX1ALDH1A1ALOX15LMNA | |
| Acrylic Acid SCHEMBL28944965 | 0.79 | LMNA (0.48) | CYP1A2EPHX1ALDH1A1ALOX15LMNA | |
| Methylcyclopentane SCHEMBL27727030 | 0.78 | FFAR3 (0.53) | CYP1A2EPHX1ALDH1A1LMNAACHE | |
| Propionic Acid SCHEMBL4088363 | 0.78 | FFAR3 (0.53) | CYP1A2EPHX1ALDH1A1LMNAACHE | |
| Propionic Acid SCHEMBL8614869 | 0.78 | FFAR3 (0.53) | CYP1A2EPHX1ALDH1A1LMNAACHE | |
| Glycolic Acid SCHEMBL9935780 | 0.76 | CYP1A2 (0.44) | CYP1A2EPHX1ALDH1A1LMNAKMT2A | |
| SCHEMBL7725154 | 0.76 | TFPI2 (0.35) | ALDH1A1CYP2D6ALOX15LMNAKMT2A | |
| SCHEMBL28795293 | 0.75 | ALDH1A1 (0.35) | EPHX1ALDH1A1NPSR1CASP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102153553-A | Oral administration carbapenem compound containing amino sulfonamide-azetidine | SHANDONG XUANZHU PHARMACEUTICAL CO LTD OWN | 2011-08-17 | — | — | CN | disclosed |