Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL28792162 | 0.88 | ACHE (0.69) | ACHELMNATSHRALOX12TP53 | |
| Toluene SCHEMBL6697996 | 0.87 | ACHE (0.79) | ACHELMNATSHRALOX12TP53 | |
| Toluene SCHEMBL10458549 | 0.84 | ACHE (0.73) | ACHELMNATSHRALOX12TP53 | |
| Toluene SCHEMBL991792 | 0.84 | ACHE (0.73) | ACHELMNATSHRALOX12TP53 | |
| Toluene SCHEMBL28125467 | 0.83 | — | — | |
| Toluene SCHEMBL175861 | 0.83 | ACHE (1.00) | ACHELMNATSHRALOX12HPGD | |
| SCHEMBL12344943 | 0.83 | ACHE (1.00) | ACHELMNATSHRALOX12HPGD | |
| Toluene SCHEMBL4429042 | 0.83 | ACHE (1.00) | ACHELMNATSHRALOX12HPGD | |
| Toluene SCHEMBL8824270 | 0.83 | ACHE (1.00) | ACHELMNATSHRALOX12HPGD | |
| Toluene SCHEMBL1 | 0.83 | — | — |
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-2005000908-A2 | PROCESS FOR THE PREPARATION OF A CATALYST AND PROCESS OF POLYMERIZATION USING SUPERCRITICAL FLUIDS AND/OR FLUIDS AT HIGH PRESSURES AND ITS USE | COPPE/UFRJ - COORDENAÇÃO DOS PROGRAMAS DE PÓS GRADUAÇÃO DE ENGENHARIA DA UNIVERSIDADE FEDERAL DO RIO DE JANEIRO (BR) | 2005-01-06 | — | — | WO | disclosed |