Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CCND1 | P24385 | 1/20 | 0.33 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31011235 | 1.00 | TP53 (0.41) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL29941513 | 0.85 | CNR2 (0.46) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL8276420 | 0.85 | CNR2 (0.46) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL16707769 | 0.75 | TP53 (0.42) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL26551208 | 0.73 | CNR2 (0.39) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL4427808 | 0.72 | ADRA2C (0.53) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL5739994 | 0.71 | DRD2 (0.53) | ADRA2CALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL10297209 | 0.70 | CNR2 (0.48) | TP53ADRA2CCNR2MAPTCYP3A4 | |
| SCHEMBL25896631 | 0.70 | MAPT (0.44) | TP53ADRA2CCNR2ALDH1A1GAA | |
| SCHEMBL1109589 | 0.70 | CNR2 (0.41) | TP53ADRA2CCNR2ALDH1A1GAA |
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-118206501-A | Preparation method of rumorph | 西安远大科创医药科技有限公司 | 2024-06-18 | — | — | CN | disclosed |