Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGIR | P43119 | 3/20 | 0.56 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Clanobutin SCHEMBL667903 | 1.00 | PTGIR (0.56) | PTGIRPDE4BTSHRHPGDTP53 | |
| Clanobutin SCHEMBL3850118 | 0.99 | PTGIR (0.55) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11946690 | 0.96 | PTGIR (0.55) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11314317 | 0.95 | PTGIR (0.52) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11117499 | 0.95 | PTGIR (0.54) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11115783 | 0.95 | PTGIR (0.54) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11116578 | 0.95 | PTGIR (0.54) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11311657 | 0.94 | PTGIR (0.51) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11217740 | 0.92 | PTGIR (0.53) | PTGIRPDE4BTSHRHPGDTP53 | |
| SCHEMBL11312100 | 0.92 | PTGIR (0.48) | PTGIRPDE4BTSHRHPGDTP53 |
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-1931760-A2 | MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS | The University of Alabama (US) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007044693-A2 | MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS | THE UNIVERSITY OF ALABAMA (US) | 2007-04-19 | — | — | WO | disclosed |