Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19585423 | 0.81 | ALDH1A1 (0.36) | POLBNFKB1NFKB2RELAMEN1 | |
| SCHEMBL871764 | 0.79 | KDM1A (0.34) | MEN1KMT2AKDM1AMAPK1 | |
| SCHEMBL13728479 | 0.77 | ALDH1A1 (0.38) | NFKB1NFKB2RELAMEN1ALDH1A1 | |
| SCHEMBL18346711 | 0.74 | ALOX15 (0.42) | POLBMEN1ALDH1A1KMT2AALOX15 | |
| SCHEMBL15423567 | 0.74 | MAPK1 (0.37) | MEN1KMT2AALOX15KDM1AMAPK1 | |
| SCHEMBL5116398 | 0.74 | ALOX15 (0.42) | POLBMEN1ALDH1A1KMT2AALOX15 | |
| SCHEMBL15695026 | 0.73 | ALDH1A1 (0.39) | NFKB1NFKB2RELAMEN1ALDH1A1 | |
| SCHEMBL15106241 | 0.72 | NFKB1 (0.36) | POLBNFKB1NFKB2RELAMEN1 | |
| SCHEMBL14920868 | 0.72 | OPRM1 (0.37) | POLBNFKB1NFKB2RELAMEN1 | |
| SCHEMBL375254 | 0.72 | CYP4F2 (0.33) | MEN1KMT2AMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111155-B | A kind of synthetic method of 4,7- diaza spiro [2.5] octane -7- t-butyl formate | 武汉工程大学 | 2018-12-14 | — | — | CN | claimed |
| CN-105111155-A | Synthesis method of tert-butyl 4,7-diazaspiro[2.5]octyl-7-formate | WUHAN INST TECHNOLOGY | 2015-12-02 | — | — | CN | claimed |
| CN-105111155-B | A kind of synthetic method of 4,7- diaza spiro [2.5] octane -7- t-butyl formate | 武汉工程大学 | 2018-12-14 | — | — | CN | disclosed |
| CN-105111155-A | Synthesis method of tert-butyl 4,7-diazaspiro[2.5]octyl-7-formate | WUHAN INST TECHNOLOGY | 2015-12-02 | — | — | CN | disclosed |