Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 5/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | BCL2 | P10415 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD5 | P21918 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30715510 | 0.86 | CYP11B2 (0.50) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL6420892 | 0.79 | CYP11B1 (0.56) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL30715511 | 0.79 | CYP11B2 (0.56) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL9054140 | 0.77 | PTGS2 (0.78) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL629729 | 0.76 | CYP11B1 (0.54) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL346730 | 0.76 | CYP11B2 (0.54) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL225731 | 0.76 | CYP11B1 (0.54) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL19600975 | 0.75 | CYP11B1 (0.52) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL30952382 | 0.75 | CYP11B2 (0.73) | CYP11B1CYP11B2PTGS2CYP19A1MAOA | |
| SCHEMBL22568904 | 0.75 | CYP11B2 (0.73) | CYP11B1CYP11B2PTGS2CYP19A1MAOA |
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-117126126-A | Method for asymmetrically synthesizing adjacent halohydrin compound | 凯特立斯（深圳）科技有限公司 | 2023-11-28 | — | — | CN | disclosed |