Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | RELA | Q04206 | 2/20 | 0.61 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.59 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.59 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.59 |
| ▸ | ESR1 | P03372 | 2/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.59 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.59 |
| ▸ | TUBB | P07437 | 2/20 | 0.59 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.59 |
| ▸ | AHR | P35869 | 2/20 | 0.59 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.59 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.59 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL7868088 | 1.00 | KDM4E (0.64) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL756486 | 0.86 | KDM4E (0.64) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL8741689 | 0.86 | KDM4E (0.46) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL6540540 | 0.85 | PKM (0.66) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL6540537 | 0.85 | PKM (0.66) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL631998 | 0.85 | RELA (0.81) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL699458 | 0.85 | RELA (0.81) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL13790336 | 0.85 | RELA (0.81) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL4881152 | 0.85 | RELA (0.81) | KDM4ECYP3A4LMNAALDH1A1TP53 | |
| SCHEMBL14950253 | 0.85 | RELA (0.81) | KDM4ECYP3A4LMNAALDH1A1TP53 |
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-113683491-A | Preparation method of 4- (2-bromoethyl) phenol | 王传良 | 2021-11-23 | — | — | CN | disclosed |