Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1733953 | 0.98 | EPHX1 (0.39) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL21269436 | 0.95 | EPHX1 (0.38) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL21269775 | 0.95 | EPHX1 (0.38) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL21269303 | 0.95 | EPHX1 (0.38) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL28314566 | 0.95 | EPHX1 (0.38) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL28314811 | 0.95 | EPHX1 (0.38) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL11814849 | 0.95 | KEAP1 (0.41) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL28314608 | 0.93 | EPHX1 (0.37) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL28314707 | 0.93 | EPHX1 (0.37) | EPHX1KEAP1NFE2L2SSTR4CES2 | |
| SCHEMBL28315747 | 0.93 | EPHX1 (0.37) | EPHX1KEAP1NFE2L2SSTR4CES2 |
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-110172019-A | The metal salt of malonic acid as the nucleating additive for crystalline thermoplastic | 印度石油有限公司 | 2019-08-27 | — | — | CN | claimed |
| CN-110172019-A | The metal salt of malonic acid as the nucleating additive for crystalline thermoplastic | 印度石油有限公司 | 2019-08-27 | — | — | CN | disclosed |