Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.51 |
| ▸ | CES1 | P23141 | 1/20 | 0.51 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | MITF | O75030 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ELANE | P08246 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5217880 | 0.89 | MAPT (0.63) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL3062323 | 0.84 | KMT2A (0.60) | MAPTNPC1RAB9APOLBKMT2A | |
| SCHEMBL15665536 | 0.81 | CA1 (0.52) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL5215589 | 0.80 | CES2 (0.57) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL6642403 | 0.80 | NPC1 (0.63) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL7093345 | 0.79 | NPC1 (0.56) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL7560417 | 0.79 | L3MBTL1 (0.66) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL23674188 | 0.78 | NPC1 (0.61) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL28419390 | 0.78 | ELANE (0.55) | MAPTNPC1RAB9APOLBMEN1 | |
| SCHEMBL812736 | 0.78 | LMNA (0.67) | MAPTNPC1RAB9APOLBMEN1 |
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-110029356-B | method for preparing ketone or β -carbonyl ester controlled by electrochemical oxidation method | 北京大学 | 2020-06-02 | — | — | CN | disclosed |