Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 4/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23149011 | 1.00 | HSD11B1 (0.46) | HSD11B1HDAC7PSMB5ARPTGDR2 | |
| SCHEMBL5114438 | 0.87 | AR (0.51) | HSD11B1ARPDK2MAOBCYP3A4 | |
| SCHEMBL4637120 | 0.85 | AKR1C3 (0.51) | HSD11B1HDAC7PSMB5ARPDK2 | |
| SCHEMBL26375405 | 0.83 | KIF11 (0.42) | HSD11B1ARAKR1C3AKR1C2MAPT | |
| SCHEMBL26375409 | 0.82 | HSD11B1 (0.50) | HSD11B1ARPDK2CYP1A2CYP3A4 | |
| SCHEMBL26375407 | 0.82 | NFE2L2 (0.45) | ARAKR1C3AKR1C2MAPTCYP1A2 | |
| SCHEMBL16363206 | 0.81 | KIF11 (0.51) | HSD11B1ARPDK2AKR1C3AKR1C2 | |
| SCHEMBL12439813 | 0.81 | CYP46A1 (0.46) | HSD11B1MAPTS1PR1S1PR3KDM4E | |
| SCHEMBL29890189 | 0.81 | HSD11B1 (0.48) | HSD11B1PSMB5ARPTGDR2AKR1C3 | |
| SCHEMBL28838153 | 0.81 | HSD11B1 (0.48) | HSD11B1PSMB5ARPTGDR2AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114401968-A | Novel heterocyclic monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2022-04-26 | — | — | CN | disclosed |