Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16878687 | 1.00 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL1577673 | 0.80 | CYP11B2 (0.46) | CYP11B1CYP11B2CYP19A1KDM1AGPR84 | |
| SCHEMBL30715534 | 0.73 | HTR2A (0.41) | CYP11B1CYP11B2CYP19A1KDM1AHTR2A | |
| SCHEMBL10402898 | 0.73 | CYP11B1 (0.56) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL24386545 | 0.71 | KDM1A (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL4623181 | 0.71 | KDM1A (0.50) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL13445302 | 0.71 | KDM1A (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL5029738 | 0.71 | KDM1A (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL11025756 | 0.71 | KDM1A (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH | |
| SCHEMBL227232 | 0.71 | KDM1A (0.46) | CYP11B1CYP11B2CYP19A1KDM1ANISCH |
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 |