Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | C1S | P09871 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | DDX3X | O00571 | 1/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28117631 | 0.83 | MAPT (0.50) | NPC1GAAKDM4EALDH1A1MAPT | |
| SCHEMBL28118080 | 0.79 | KDM1A (0.54) | NPC1PARP1ARKDM4EALDH1A1 | |
| SCHEMBL28117629 | 0.76 | MAPK10 (0.49) | NPC1PARP1ALDH1A1HPGDMEN1 | |
| SCHEMBL28118045 | 0.76 | LOXL2 (0.47) | GAAKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL29837038 | 0.74 | AR (0.65) | ARALDH1A1MAPTMEN1LMNA | |
| SCHEMBL21647109 | 0.74 | AR (0.65) | ARALDH1A1MAPTMEN1LMNA | |
| SCHEMBL21647108 | 0.74 | AR (0.65) | ARALDH1A1MAPTMEN1LMNA | |
| SCHEMBL2090387 | 0.74 | C1S (0.50) | NPC1C1SPARP1GAAKDM4E | |
| SCHEMBL27567095 | 0.71 | TRPA1 (0.48) | NPC1GAAKDM4EALDH1A1MAPT | |
| SCHEMBL684640 | 0.70 | KDM1A (0.73) | NPC1KDM4EMAPTHPGDMEN1 |
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-106278831-A | 2-phenethyl phenol derivatives and the preparation method of intermediate thereof and intermediate | 联化科技（台州）有限公司 | 2017-01-04 | — | — | CN | disclosed |