Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.78 |
| ▸ | MAPT | P10636 | 3/20 | 0.78 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | KDM6B | O15054 | 1/20 | 0.47 |
| ▸ | KDM5C | P41229 | 1/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.47 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.43 |
| ▸ | PIR | O00625 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL45146 | 0.94 | MAPT (0.68) | KDM4EMAPTGAAALDH1A1PLAU | |
| SCHEMBL29995197 | 0.94 | MAPT (0.68) | KDM4EMAPTGAAALDH1A1PLAU | |
| Hydrochloric Acid SCHEMBL1856980 | 0.93 | MAPT (0.66) | KDM4EMAPTGAAALDH1A1PLAU | |
| Hydrochloric Acid SCHEMBL1264485 | 0.89 | MAPT (0.60) | KDM4EMAPTGAAALDH1A1PLAU | |
| SCHEMBL45202 | 0.89 | KDM4E (1.00) | KDM4EMAPTGAAALDH1A1PLAU | |
| SCHEMBL29673258 | 0.89 | KDM4E (1.00) | KDM4EMAPTGAAALDH1A1PLAU | |
| SCHEMBL288320 | 0.86 | MAPT (0.54) | KDM4EMAPTGAAALDH1A1CRBN | |
| SCHEMBL30445913 | 0.86 | MAPT (0.54) | KDM4EMAPTGAAALDH1A1CRBN | |
| Hydrochloric Acid SCHEMBL699425 | 0.84 | MAPT (0.53) | KDM4EMAPTGAAALDH1A1CRBN | |
| SCHEMBL30955089 | 0.83 | MAPT (0.51) | KDM4EMAPTGAAALDH1A1CRBN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115626889-B | Organic chemical conversion method for oxidative dehydrogenation of nitrogen-containing heterocyclic compound | 南京工业大学 | 2024-04-30 | — | — | CN | claimed |
| CN-115626889-B | Organic chemical conversion method for oxidative dehydrogenation of nitrogen-containing heterocyclic compound | 南京工业大学 | 2024-04-30 | — | — | CN | disclosed |