Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 6/20 | 0.33 |
| ▸ | FAAH | O00519 | 5/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 3/20 | 0.30 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8366044 | 0.84 | CTSK (0.41) | MLYCDCTSKCA12CA2CA9 | |
| SCHEMBL9010937 | 0.81 | RIPK1 (0.37) | CA12CA2CA9RIPK1TSHR | |
| SCHEMBL12741115 | 0.79 | CA12 (0.34) | CTSKCA12CA2CA9RIPK1 | |
| SCHEMBL21896014 | 0.77 | RIPK1 (0.50) | RIPK1 | |
| SCHEMBL25467799 | 0.77 | MLYCD (0.33) | MLYCDCA12CA2CA9PDK2 | |
| SCHEMBL12452607 | 0.76 | FAAH (0.39) | CTSKCA12CA9PDK2FAAH | |
| SCHEMBL4570201 | 0.74 | THRB (0.42) | MLYCDPDK2 | |
| SCHEMBL20018677 | 0.72 | CA12 (0.32) | CA12CA2CA9RIPK1CA1 | |
| SCHEMBL18760966 | 0.72 | RIPK1 (0.35) | CA12CA2CA9RIPK1 | |
| SCHEMBL16508865 | 0.71 | FAAH (0.43) | CTSKCA12CA9FAAHCA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3731329-A1 | ELECTROLYTE, ELECTROCHEMICAL DEVICE, LITHIUM ION SECONDARY BATTERY, AND MODULE | DAIKIN INDUSTRIES, LTD. (JP) | 2020-10-28 | — | — | EP | disclosed |
| WO-2015087151-A1 | NOVEL AZAINDOLE DERIVATIVES AS SELECTIVE HISTONE DEACETYLASE (HDAC) INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2015-06-18 | — | — | WO | disclosed |