Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2A13 | Q16696 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL9214168 | 0.81 | HTT (0.42) | HPGDALDH1A1HSD17B10HRH3ALOX15 | |
| SCHEMBL19288768 | 0.80 | SIGMAR1 (0.43) | CXCR4ALDH1A1HRH3ALOX15MEN1 | |
| SCHEMBL31411132 | 0.75 | SIGMAR1 (0.58) | ALDH1A1HRH3KMT2ALMNA | |
| SCHEMBL7278898 | 0.71 | ALOX15 (0.76) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL4982004 | 0.69 | HPGD (0.43) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL18325474 | 0.67 | ALOX15 (0.67) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL13847837 | 0.66 | TYMP (0.49) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL4851191 | 0.66 | CXCR4 (0.44) | HPGDCXCR4ALDH1A1HSD17B10HRH3 | |
| SCHEMBL23895391 | 0.64 | ALDH1A1 (0.46) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL2648327 | 0.64 | CXCR4 (0.51) | HPGDCXCR4ALDH1A1HSD17B10L3MBTL1 |
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-113166116-B | Amido bridged heterocyclic compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2022-12-27 | — | — | CN | disclosed |