Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL30995162 | 0.80 | CYP11B2 (0.44) | ALDH1A1CYP11B2CYP11B1NOS3NOS1 | |
| SCHEMBL30995189 | 0.78 | CCR2 (0.47) | ALDH1A1SMN1; SMN2CYP11B2CYP11B1HTR7 | |
| SCHEMBL30995223 | 0.78 | ROCK1 (0.46) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17582958 | 0.77 | CYP11B2 (0.52) | ALDH1A1SMN1; SMN2CYP11B2CYP11B1NOS3 | |
| SCHEMBL30995183 | 0.77 | PRKACA (0.37) | ALDH1A1HTR7NOS3NOS1NOS2 | |
| SCHEMBL30995193 | 0.73 | CYP11B2 (0.40) | ALDH1A1CYP11B2CYP11B1NOS3NOS1 | |
| SCHEMBL30995208 | 0.73 | CYP11B2 (0.40) | ALDH1A1CYP11B2CYP11B1NOS3NOS1 | |
| SCHEMBL30995119 | 0.73 | PIK3CA (0.38) | ALDH1A1KMT2AL3MBTL1PRKACARPS6KB1 | |
| SCHEMBL17586640 | 0.71 | CYP11B2 (0.58) | ALDH1A1SMN1; SMN2CYP11B2CYP11B1HTR2B | |
| SCHEMBL31339892 | 0.71 | OGFRL1 (0.42) | ALDH1A1MEN1KMT2AKDM4EL3MBTL1 |
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-118530160-A | Aromatic heterocyclic compound, preparation method and application thereof | 上海翊石医药科技有限公司 | 2024-08-23 | — | — | CN | disclosed |