Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | SLC9A5 | Q14940 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2067789 | 0.80 | PIK3CD (0.35) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| SCHEMBL4479205 | 0.80 | PIK3CD (0.35) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| SCHEMBL10304981 | 0.80 | PIK3CD (0.35) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| SCHEMBL4479199 | 0.80 | PIK3CD (0.35) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| SCHEMBL13745079 | 0.79 | TSHR (0.34) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| Hydrochloric Acid SCHEMBL8984856 | 0.79 | AOC3 (0.38) | AOC3MEN1KMT2A | |
| SCHEMBL225257 | 0.78 | ALDH1A1 (0.43) | SLC6A2SLC6A4PIK3CDKDM4ENAMPT | |
| SCHEMBL731386 | 0.77 | — | — | |
| SCHEMBL23509386 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CHRM2CHRM1 | |
| SCHEMBL22900125 | 0.75 | KCNQ3 (0.41) | PIK3CDKDM4ENAMPTHDAC4ALDH1A1 |
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-2252595-B1 | OXIM DERIVATIVES AS HSP90 INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2014-03-26 | — | — | EP | disclosed |
| WO-2009097578-A1 | OXIM DERIVATIVES AS HSP90 INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-06 | — | — | WO | disclosed |