Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 9/20 | 0.62 |
| ▸ | SELL | P14151 | 1/20 | 0.43 |
| ▸ | SELP | P16109 | 1/20 | 0.43 |
| ▸ | SELE | P16581 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | APEX1 | P27695 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19509567 | 0.87 | KDM4E (0.55) | PTPN11SELLSELPSELEKDM4E | |
| SCHEMBL12610984 | 0.82 | PTPN11 (0.41) | PTPN11SELLSELPSELEKDM4E | |
| SCHEMBL20206964 | 0.79 | PTPN11 (0.40) | PTPN11SELLSELPSELEKDM4E | |
| SCHEMBL20207160 | 0.79 | PTPN11 (0.40) | PTPN11SELLSELPSELEKDM4E | |
| SCHEMBL20206977 | 0.76 | PTPN11 (0.71) | PTPN11 | |
| SCHEMBL20187640 | 0.76 | PTPN11 (1.00) | PTPN11KDM4EALDH1A1POLBGAA | |
| SCHEMBL20207112 | 0.75 | PTPN11 (0.54) | PTPN11KDM4EALDH1A1POLBGAA | |
| SCHEMBL15557274 | 0.74 | CDK2 (0.77) | PTPN11KDM4EALDH1A1POLBGAA | |
| SCHEMBL18311409 | 0.72 | SELL (0.65) | SELLSELPSELEKDM4EALDH1A1 | |
| SCHEMBL12588326 | 0.70 | SELL (0.68) | SELLSELPSELEKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018096088-A1 | HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS | UNIVERSITEIT ANTWERPEN (BE) | 2018-05-31 | — | — | WO | disclosed |