Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | PPOX | P50336 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | USP8 | P40818 | 2/20 | 0.38 |
| ▸ | USP7 | Q93009 | 2/20 | 0.38 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | LTK | P29376 | 1/20 | 0.35 |
| ▸ | GRK5 | P34947 | 1/20 | 0.35 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | PRKX | P51817 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14743082 | 0.77 | S100A4 (0.44) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL2272979 | 0.72 | S100A4 (0.46) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL482311 | 0.71 | S100A4 (0.56) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL1386281 | 0.69 | MEN1 (0.46) | S100A4CES1HSP90AA1ALDH1A1APAF1 | |
| SCHEMBL3869119 | 0.68 | S100A4 (0.45) | S100A4PTPN1ALDH1A1 | |
| SCHEMBL208231 | 0.68 | PPOX (0.42) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL4229683 | 0.67 | S100A4 (0.80) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL4319897 | 0.67 | S100A4 (0.71) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL353693 | 0.67 | S100A4 (0.80) | S100A4CES1TGM2PPOXHSP90AA1 | |
| SCHEMBL30345128 | 0.67 | S100A4 (0.90) | S100A4CES1TGM2PPOXHSP90AA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1891075-A1 | TRICYCLIC SPIRO DERIVATIVES AS CRTH2 MODULATORS | LABORATOIRES SERONO S.A. (CH) | 2008-02-27 | — | — | EP | disclosed |
| WO-2006125784-A1 | TRICYCLIC SPIRO DERIVATIVES AS CRTH2 MODULATORS | LABORATOIRES SERONO S.A. (CH) | 2006-11-30 | — | — | WO | disclosed |