Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 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 | |
|---|---|---|---|---|
| SCHEMBL27852982 | 0.86 | PPARG (0.38) | CYP2D6SMN1; SMN2LMNAMAPK1HIF1A | |
| SCHEMBL27853024 | 0.84 | PLG (0.47) | CYP2D6SMN1; SMN2LMNAMAPK1HIF1A | |
| SCHEMBL27965419 | 0.82 | CYP2D6 (0.37) | CYP2D6SMN1; SMN2LMNAMAPK1HIF1A | |
| SCHEMBL27869764 | 0.80 | CYP2D6 (0.38) | CYP2D6SMN1; SMN2LMNAMAPK1HIF1A | |
| SCHEMBL581932 | 0.80 | HTR2C (0.49) | HTR2CSMN1; SMN2ALDH1A1EPHX2EPHX1 | |
| SCHEMBL27853003 | 0.79 | KCNN4 (0.36) | EPHX2 | |
| SCHEMBL27965683 | 0.79 | ALDH1A1 (0.39) | HTR2CCYP2D6SMN1; SMN2LMNAMAPK1 | |
| SCHEMBL27853046 | 0.78 | HTR2C (0.45) | HTR2CALDH1A1 | |
| SCHEMBL28794681 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2LMNAALDH1A1 | |
| Acetic Acid SCHEMBL27852948 | 0.78 | POLB (0.52) | HTR2CCYP2D6SMN1; SMN2LMNACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102459246-B | Isoxazol-3 (2H) -one analogs as therapeutic agents | ASTRAZENECA AB | 2014-05-07 | — | — | CN | disclosed |
| CN-102459246-A | Isoxazol-3 (2H) -one analogs as therapeutic agents | ASTRAZENECA AB | 2012-05-16 | — | — | CN | disclosed |