Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.44 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | GNAI3 | P08754 | 5/20 | 0.43 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.43 |
| ▸ | GNAI1 | P63096 | 5/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.39 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20471042 | 0.87 | HRH3 (0.48) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL18909449 | 0.86 | CACNA2D1 (0.45) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL22891213 | 0.85 | EPHX1 (0.43) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL25701777 | 0.84 | HSD11B1 (0.53) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL12507042 | 0.83 | MAPT (0.49) | EPHX2 | |
| SCHEMBL18909448 | 0.83 | CACNA2D1 (0.43) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL18909455 | 0.82 | PKM (0.43) | CACNA2D1CACNA1BCACNB1CACNA1CEPHX2 | |
| SCHEMBL18909445 | 0.82 | CACNA2D1 (0.42) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL24669826 | 0.82 | CACNA2D1 (0.45) | HSD11B1HRH3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL29317068 | 0.81 | ACHE (0.53) | CACNA2D1CACNA1BCACNB1CACNA1CEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3596072-B1 | PYRAZOLOCHLOROPHENYL COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | HOFFMANN LA ROCHE (CH) | 2022-06-22 | — | — | EP | disclosed |