Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 4/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3230060 | 1.00 | ADRB2 (0.42) | ADRB2ADRB1KHKCYP11B1CYP11B2 | |
| SCHEMBL9478745 | 0.84 | XDH (0.37) | ADRB2KHKXDHGPR35MAOA | |
| SCHEMBL31020001 | 0.82 | KHK (0.40) | ADRB2ADRB1KHKCYP11B1CYP11B2 | |
| SCHEMBL29560065 | 0.78 | TRPV4 (0.39) | KHKCYP11B1CYP11B2TRPV4GPR35 | |
| SCHEMBL144243 | 0.78 | ADRB2 (0.43) | ADRB2CA1CA2CA9XDH | |
| SCHEMBL2652439 | 0.78 | ADRB2 (0.44) | ADRB2ADRB1KHKCYP11B1CYP11B2 | |
| SCHEMBL504867 | 0.78 | TRPV4 (0.39) | KHKCYP11B1CYP11B2TRPV4GPR35 | |
| SCHEMBL18343829 | 0.78 | XDH (0.34) | ADRB2XDHGPR35MAOAMAOB | |
| SCHEMBL29582221 | 0.78 | ADRB2 (0.43) | ADRB2CA1CA2CA9XDH | |
| SCHEMBL58096 | 0.77 | HDAC1 (0.44) | ADRB2CA1CA2CA9HDAC1 |
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-2023125935-A1 | BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |