Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL690407 | 0.80 | NR4A1 (0.57) | CNR2ALDH1A1KDM4ECYP1A2HSD17B10 | |
| SCHEMBL29373697 | 0.80 | NR4A1 (0.57) | CNR2ALDH1A1KDM4ECYP1A2HSD17B10 | |
| SCHEMBL1800146 | 0.80 | CYP1A2 (0.52) | ALDH1A1KDM4ECYP1A2HSD17B10KMT2A | |
| SCHEMBL28650705 | 0.79 | L3MBTL1 (0.42) | ALDH1A1KDM4ECYP1A2HSD17B10KMT2A | |
| SCHEMBL28245095 | 0.79 | CYP1A2 (0.48) | ALDH1A1KDM4ECYP1A2HSD17B10KMT2A | |
| SCHEMBL28639413 | 0.79 | MEN1 (0.44) | ALDH1A1KDM4ECYP1A2HSD17B10KMT2A | |
| SCHEMBL13209727 | 0.79 | CNR2 (0.49) | CNR2ALDH1A1KDM4ECYP1A2HSD17B10 | |
| Hydrochloric Acid SCHEMBL5415206 | 0.79 | NR4A1 (0.55) | CNR2ALDH1A1KDM4ECYP1A2HSD17B10 | |
| SCHEMBL11689360 | 0.78 | PLK1 (0.62) | CNR2ALDH1A1KDM4EHPGDGAA | |
| SCHEMBL9038317 | 0.77 | CNR2 (0.45) | CNR2ALDH1A1KDM4ECYP1A2HSD17B10 |
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-106103417-B | The derivative and preparation method thereof of 1,2- naphthoquinones | KT&G生命科学公司 | 2019-08-06 | — | — | CN | disclosed |
| CN-106103417-A | Derivant of 1,2 naphthoquinone and preparation method thereof | KT&G生命科学公司 | 2016-11-09 | — | — | CN | disclosed |