Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.67 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | METAP1 | P53582 | 1/20 | 0.50 |
| ▸ | PPOX | P50336 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | TGM2 | P21980 | 1/20 | 0.44 |
| ▸ | USP8 | P40818 | 2/20 | 0.43 |
| ▸ | USP7 | Q93009 | 2/20 | 0.43 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.43 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL353693 | 0.85 | S100A4 (0.80) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL1133148 | 0.85 | S100A4 (0.90) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL4229683 | 0.85 | S100A4 (0.80) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL30345128 | 0.85 | S100A4 (0.90) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL10924194 | 0.85 | S100A4 (0.50) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL29581505 | 0.80 | S100A4 (0.71) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL2599342 | 0.80 | S100A4 (1.00) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL4319897 | 0.80 | S100A4 (0.71) | S100A4HSP90AA1METAP1PPOXCES1 | |
| SCHEMBL155593 | 0.79 | S100A4 (0.87) | S100A4HSP90AA1PPOXCES1ITGA1 | |
| SCHEMBL29378883 | 0.79 | S100A4 (0.87) | S100A4HSP90AA1PPOXCES1ITGA1 |
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-2096108-A1 | Novel organic electroluminescent compounds and organic electroluminscent device using the same | Gracel Display Inc. (KR) | 2009-09-02 | — | — | EP | disclosed |