Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | UTS2R | Q9UKP6 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28927515 | 0.94 | EPHX1 (0.61) | EPHX1HPGDTDP1ALDH1A1MAPT | |
| SCHEMBL9000896 | 0.90 | EPHX1 (0.57) | EPHX1CNR2UTS2RHPGDTDP1 | |
| SCHEMBL6933198 | 0.77 | L3MBTL1 (0.54) | EPHX1HPGDTDP1ALDH1A1MAPT | |
| SCHEMBL23386539 | 0.76 | MEN1 (0.52) | HPGDTDP1ALDH1A1MAPTLMNA | |
| SCHEMBL11269147 | 0.76 | ALDH1A1 (0.52) | EPHX1HPGDTDP1ALDH1A1MAPT | |
| SCHEMBL28657755 | 0.75 | ALOX15 (0.44) | EPHX1HPGDTDP1ALDH1A1MAPT | |
| SCHEMBL28639127 | 0.74 | ALOX15 (0.46) | EPHX1HPGDALDH1A1MAPTLMNA | |
| SCHEMBL28405884 | 0.71 | LMNA (0.42) | HPGDALDH1A1MAPTLMNAGAA | |
| SCHEMBL29113671 | 0.70 | ALOX15 (0.47) | HPGDALDH1A1MAPTKMT2A | |
| SCHEMBL9869760 | 0.70 | KLK7 (0.52) | CNR2HPGDALDH1A1LMNAGAA |
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-113582896-A | Method for realizing S-H bond insertion reaction of sulfhydryl compound by using photocatalytic microchannel reactor | 南京先进生物材料与过程装备研究院有限公司 | 2021-11-02 | — | — | CN | disclosed |