Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30487408 | 0.82 | ADRB2 (0.42) | KHKADRB2ADRB1CYP11B1CYP11B2 | |
| SCHEMBL3230060 | 0.82 | ADRB2 (0.42) | KHKADRB2ADRB1CYP11B1CYP11B2 | |
| SCHEMBL9478745 | 0.75 | XDH (0.37) | KHKADRB2XDH | |
| SCHEMBL18343829 | 0.70 | XDH (0.34) | ADRB2XDH | |
| SCHEMBL144243 | 0.70 | ADRB2 (0.43) | ADRB2XDH | |
| SCHEMBL2652439 | 0.70 | ADRB2 (0.44) | KHKADRB2ADRB1CYP11B1CYP11B2 | |
| SCHEMBL29582221 | 0.70 | ADRB2 (0.43) | ADRB2XDH | |
| SCHEMBL2656138 | 0.67 | ADRB2 (0.35) | ADRB2XDH | |
| SCHEMBL6119734 | 0.67 | CYP3A4 (0.36) | KHKADRB2TRPV4XDH | |
| SCHEMBL31025416 | 0.67 | XDH (0.51) | ADRB2CYP11B1CYP11B2XDH |
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 |
|---|---|---|---|---|---|---|---|
| CN-119948023-A | Regulator containing piperidine polycyclic derivative, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2025-05-06 | — | — | CN | disclosed |
| CN-118451079-A | Benzopiperidine derivative modulators, methods of preparation and uses thereof | 上海翰森生物医药科技有限公司 | 2024-08-06 | — | — | CN | disclosed |