Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | FLT4 | P35916 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047441 | 0.85 | MAPT (0.52) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL15047786 | 0.81 | MAPT (0.67) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL28375941 | 0.80 | AKT1 (0.54) | ALDH1A1LMNAKDM4EPTGS2EPHX1 | |
| SCHEMBL24554797 | 0.78 | ALDH1A1 (0.53) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL28959084 | 0.77 | MAPT (0.61) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL4924405 | 0.76 | ALDH1A1 (0.55) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL195428 | 0.76 | ALDH1A1 (0.50) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL31195505 | 0.74 | ALDH1A1 (0.55) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL28465274 | 0.74 | ALDH1A1 (0.55) | MAPTALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL9117609 | 0.74 | LMNA (0.63) | MAPTALDH1A1LMNAKDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021139395-A1 | HIGH-EFFICIENCY LOW-TOXICITY ANTI-CANCER COMPOUND SYNTHESIZED BY AUTOCATALYSIS IN CELLS AND LIVING BODIES AND SYNTHESIS METHOD FOR ANTI-CANCER COMPOUND | 南京师范大学 | 2021-07-15 | — | — | WO | disclosed |