Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13973324 | 0.82 | TSHR (0.54) | CA1CYP2D6TSHRHIF1ARECQL | |
| SCHEMBL27580254 | 0.81 | CYP1A2 (0.53) | ACHECYP2D6BCHECYP3A4CYP2C9 | |
| SCHEMBL2471147 | 0.80 | CHRM2 (0.62) | CYP2D6MEN1KMT2ATP53CYP3A4 | |
| Acetic Acid SCHEMBL11588114 | 0.80 | CA1 (0.46) | ACHECA1HSP90AA1CYP2D6ALOX12 | |
| SCHEMBL1552241 | 0.79 | HSP90AA1 (0.50) | ACHECA1HSP90AA1GABRA1GABRB2 | |
| Ammonia Solution, Strong SCHEMBL16269082 | 0.79 | CHRM2 (0.60) | CYP2D6MEN1KMT2ATP53CYP3A4 | |
| SCHEMBL573718 | 0.78 | GABRA1 (0.70) | ACHECA1HSP90AA1TSHRALOX12 | |
| Formic Acid SCHEMBL5072921 | 0.76 | NPC1 (0.53) | CYP2D6MEN1KMT2ATP53CYP3A4 | |
| SCHEMBL13970811 | 0.76 | KDM4E (0.55) | ACHECYP2D6BCHEMEN1KMT2A | |
| 2-Chlorophenol SCHEMBL15717544 | 0.75 | ALDH1A1 (0.52) | ACHECA1HSP90AA1TSHRGABRA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100548976-C | The sulfone amide derivative that is used for the treatment of disease | PFIZER LTD (US) | 2009-10-14 | — | — | CN | disclosed |
| CN-1934071-A | Carboxamide derivatives useful as adrenergic receptors | PFIZER LTD (US) | 2007-03-21 | — | — | CN | disclosed |
| CN-1910143-A | Sulfonamide derivatives for the treatment of diseases | PFIZER LTD (US) | 2007-02-07 | — | — | CN | disclosed |