Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15546178 | 0.75 | KDM4E (0.51) | KDM4EPTGDR2HSD17B10MAPK1SMN1; SMN2 | |
| SCHEMBL7166224 | 0.74 | MAPT (0.59) | KDM4EPOLBPTGDR2HSD17B10RAB9A | |
| SCHEMBL5462008 | 0.74 | KDM4E (0.77) | KDM4EPOLBRAB9ANPC1MAPT | |
| SCHEMBL5461161 | 0.71 | PTK2 (0.51) | POLBPTGDR2HSD17B10MAPK8RAB9A | |
| SCHEMBL16737137 | 0.71 | AKR1C3 (0.57) | KDM4EPOLBHSD17B10MAPK8RAB9A | |
| SCHEMBL11612619 | 0.71 | HSD17B10 (0.45) | KDM4EPOLBPTGDR2HSD17B10MAPT | |
| SCHEMBL11283565 | 0.71 | MAPK8 (0.40) | MAPK8RAB9ANPC1MAPK1TP53 | |
| SCHEMBL11427409 | 0.70 | AKR1C3 (0.50) | KDM4EPOLBPTGDR2HSD17B10RAB9A | |
| SCHEMBL12050110 | 0.70 | MAPT (0.69) | KDM4EPOLBPTGDR2RAB9ANPC1 | |
| SCHEMBL11348937 | 0.69 | PTGDR2 (0.40) | POLBPTGDR2SMN1; SMN2LMNA |
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-102947298-B | Alkaloid aminoester derivatives and pharmaceutical compositions thereof | CHIESI FARMACEUTICI S.P.A. (IT) | 2016-03-02 | — | — | CN | disclosed |