Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | NSD2 | O96028 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL1257814 | 0.81 | SMN1; SMN2 (0.39) | SMN1; SMN2GLASTING1CYP1A2CYP3A4 | |
| SCHEMBL1257818 | 0.81 | SMN1; SMN2 (0.54) | SMN1; SMN2GLASTING1CYP1A2CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL28714250 | 0.79 | SMN1; SMN2 (0.53) | SMN1; SMN2GLASTING1CYP1A2CYP3A4 | |
| SCHEMBL7120045 | 0.79 | HTT (0.38) | SMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL11921702 | 0.75 | PPARG (0.36) | SMN1; SMN2GLASTING1CYP1A2CYP3A4 | |
| SCHEMBL1171323 | 0.75 | ALDH1A1 (0.35) | SMN1; SMN2GLASTING1CYP1A2CYP3A4 | |
| SCHEMBL9268651 | 0.73 | NPC1 (0.44) | SMN1; SMN2ALDH1A1MEN1KMT2ASRC | |
| SCHEMBL9045253 | 0.72 | CTBP2 (0.55) | SMN1; SMN2ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL598503 | 0.72 | TDP2 (0.37) | SMN1; SMN2CYP1A2HSD17B10ALDH1A1TSHR | |
| SCHEMBL31095112 | 0.72 | TDP2 (0.37) | SMN1; SMN2CYP1A2HSD17B10ALDH1A1TSHR |
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-1887000-A1 | ARYLACETATE DERIVATIVE HAVING ISOXAZOLE SKELETON | Shionogi Co., Ltd. (JP) | 2008-02-13 | — | — | EP | disclosed |