Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 7/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | HPGDS | O60760 | 2/20 | 0.55 |
| ▸ | TACR3 | P29371 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ACR | P10323 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16111837 | 0.86 | ALPL (0.60) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL18187534 | 0.83 | MAPT (0.62) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL16682538 | 0.81 | ALPL (0.54) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL595997 | 0.81 | ALPL (0.75) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL16112288 | 0.80 | HPGDS (0.54) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL31461711 | 0.80 | MAPT (0.67) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL17895628 | 0.79 | ALPL (0.72) | ALPLMAPTTP53CASP3SENP8 | |
| SCHEMBL30271602 | 0.79 | ALPL (0.68) | ALPLTP53TACR3CA12CA1 | |
| SCHEMBL14152739 | 0.79 | ALPL (0.68) | ALPLTP53TACR3CA12CA1 | |
| SCHEMBL2824803 | 0.78 | ALPL (0.76) | ALPLMAPTTP53CASP3SENP8 |
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-115745891-A | Pyrazole derivatives as beta 2 Use of allosteric antagonists of the adrenergic receptor | 常州大学 | 2023-03-07 | — | — | CN | disclosed |