Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.44 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28662908 | 0.87 | PTGS2 (0.43) | ALDH1A1HPGDHTR7CYP2A6PDCD1 | |
| SCHEMBL616 | 0.84 | ESR2 (0.54) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| SCHEMBL29706107 | 0.84 | ESR2 (0.54) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Biphenyl SCHEMBL4733975 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Water SCHEMBL8948779 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Biphenyl SCHEMBL4603527 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Bromide SCHEMBL1925857 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Iodide SCHEMBL31053161 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Ammonia Solution, Strong SCHEMBL19032131 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 | |
| Hydrochloric Acid SCHEMBL28832617 | 0.82 | ESR2 (0.52) | ENPP3ENPP1ALDH1A1HPGDNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109716544-A | LED Encapulant composition | 日产化学株式会社 | 2019-05-03 | — | — | CN | disclosed |