Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MARS1 | P56192 | 7/20 | 0.58 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.51 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.46 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GRN | P28799 | 2/20 | 0.42 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25413418 | 0.84 | FAAH (0.52) | MALT1POLBKMT2A | |
| SCHEMBL25410777 | 0.83 | MARS1 (0.52) | MARS1MALT1P2RY14PTGER1CYP1A2 | |
| SCHEMBL25410772 | 0.82 | MARS1 (0.54) | MARS1MALT1P2RY14PTGER1CYP1A2 | |
| SCHEMBL29699906 | 0.77 | MARS1 (0.57) | MARS1MALT1P2RY14PTGER1CYP1A2 | |
| SCHEMBL25410771 | 0.76 | MARS1 (0.62) | MARS1MALT1P2RY14MGLLTP53 | |
| SCHEMBL27811126 | 0.76 | CA12 (0.56) | MARS1MALT1 | |
| SCHEMBL27831427 | 0.76 | MARS1 (0.53) | MARS1MALT1P2RY14KMT2AMEN1 | |
| SCHEMBL27811259 | 0.75 | MARS1 (0.52) | MARS1MALT1P2RY14KMT2A | |
| SCHEMBL15056101 | 0.75 | P2RY14 (0.53) | MARS1MALT1P2RY14PTGER1CYP1A2 | |
| SCHEMBL2455065 | 0.75 | GRN (0.64) | MARS1MALT1P2RY14PTGER1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023165168-A1 | APPLICATION OF PYRAZOLE DERIVATIVE AS β2 ADRENERGIC RECEPTOR ALLOSTERIC MODULATOR, ANTAGONIST AND AGONIST | 常州大学 | 2023-09-07 | — | — | WO | disclosed |
| CN-115894373-A | N-substituted benzylpyrazole derivatives as beta 2 Use of allosteric modulators, antagonists and agonists of the adrenergic receptor | 常州大学 | 2023-04-04 | — | — | CN | disclosed |