Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 14/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL1759343 | 0.76 | MAPT (0.54) | ESR1ESR2MAPTMEN1KMT2A | |
| SCHEMBL5508112 | 0.75 | ESR1 (0.63) | ESR1ESR2HSP90AA1MAPT | |
| SCHEMBL29793168 | 0.72 | FAAH (0.49) | ESR1ESR2HSP90AA1MAPTFAAH | |
| SCHEMBL5513632 | 0.72 | FAAH (0.49) | ESR1ESR2HSP90AA1MAPTFAAH | |
| SCHEMBL2708342 | 0.72 | PIM1 (0.49) | ESR1ESR2HSP90AA1 | |
| SCHEMBL5511112 | 0.72 | ESR1 (0.42) | ESR1ESR2HSP90AA1MAPT | |
| SCHEMBL5511923 | 0.72 | ESR1 (0.42) | ESR1ESR2HSP90AA1MAPT | |
| SCHEMBL12879280 | 0.72 | ESR1 (0.42) | ESR1ESR2HSP90AA1MAPT | |
| SCHEMBL13406079 | 0.71 | TRPA1 (0.44) | ESR1ESR2HSP90AA1MAPTMEN1 | |
| SCHEMBL13201416 | 0.71 | TRPA1 (0.47) | ESR1ESR2MAPTMEN1KMT2A |
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-2011020615-A1 | NOVEL FXR (NR1H4 ) BINDING AND ACTIVITY MODULATING COMPOUNDS | PHENEX PHARMACEUTICALS AG (DE) | 2011-02-24 | — | — | WO | disclosed |