Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | PTPRC | P08575 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18175535 | 0.89 | NPC1 (0.34) | S100A4CA1CA2CA4CA7 | |
| SCHEMBL29164456 | 0.85 | LMNA (0.36) | — | |
| SCHEMBL31270684 | 0.85 | LMNA (0.36) | — | |
| SCHEMBL31270910 | 0.85 | LMNA (0.36) | — | |
| SCHEMBL29696466 | 0.85 | LMNA (0.36) | — | |
| SCHEMBL29294962 | 0.85 | PDK2 (0.37) | S100A4CA1CA2CA4CA7 | |
| SCHEMBL1993181 | 0.84 | PDK2 (0.39) | S100A4CA1CA2CA4CA7 | |
| SCHEMBL29375527 | 0.84 | PDK2 (0.39) | S100A4CA1CA2CA4CA7 | |
| SCHEMBL22958568 | 0.83 | NPC1 (0.34) | S100A4CA1CA2CA4CA7 | |
| SCHEMBL16628900 | 0.81 | APEX1 (0.39) | PGRPTPRCTDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3085693-A1 | NOVEL 3,6-DISUBSTITUTED FLUORENE DERIVATIVES | Solvay SA (BE) | 2016-10-26 | — | — | EP | disclosed |