Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 6/20 | 0.36 |
| ▸ | BCR | P11274 | 6/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 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 | |
|---|---|---|---|---|
| SCHEMBL5607253 | 0.86 | MAPT (0.38) | MAPTADAMTS5FAAHMGLLMEN1 | |
| SCHEMBL5606886 | 0.84 | PLK1 (0.33) | PLK1HDAC1ABL1BCRMAPT | |
| SCHEMBL5606238 | 0.81 | PGR (0.38) | MAPTADAMTS5FAAHMGLLMEN1 | |
| SCHEMBL17844220 | 0.77 | FAAH (0.40) | FAAHMGLLATMSMN1; SMN2MEN1 | |
| SCHEMBL5613996 | 0.77 | MAPT (0.46) | ABL1MAPTSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL5607329 | 0.77 | NPC1 (0.41) | MEN1ALDH1A1KMT2A | |
| SCHEMBL17844161 | 0.75 | FAAH (0.44) | MAPTTP53FAAHMGLLATM | |
| SCHEMBL5614183 | 0.75 | P2RX3 (0.37) | EPHX2SMN1; SMN2ALDH1A1GAAKMT2A | |
| SCHEMBL17844174 | 0.74 | FAAH (0.40) | PLK1MAPTFAAHMGLLATM | |
| SCHEMBL17844158 | 0.73 | GAA (0.43) | MAPTTP53ATMSMN1; SMN2MEN1 |
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-1838686-A1 | DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | AstraZeneca AB (SE) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006073363-A1 | DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATORS | ASTRAZENECA AB (SE) | 2006-07-13 | — | — | WO | disclosed |