Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 2/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15036885 | 0.90 | KEAP1 (0.44) | CYP1B1STSFAAHMGLLKEAP1 | |
| SCHEMBL15036886 | 0.88 | KEAP1 (0.48) | CYP1B1STSKEAP1NFE2L2HSD17B1 | |
| SCHEMBL15036894 | 0.83 | CYP1B1 (0.58) | CYP1B1STSKEAP1NFE2L2P2RY14 | |
| SCHEMBL15244877 | 0.82 | KEAP1 (0.55) | STSKEAP1NFE2L2HSD17B1HSD17B2 | |
| SCHEMBL15036903 | 0.79 | KEAP1 (0.49) | CYP1B1STSFAAHMGLLKEAP1 | |
| SCHEMBL15274989 | 0.78 | CYP1B1 (0.56) | CYP1B1STSKEAP1NFE2L2P2RY14 | |
| SCHEMBL15274988 | 0.78 | CYP1B1 (0.56) | CYP1B1STSKEAP1NFE2L2P2RY14 | |
| SCHEMBL16603465 | 0.77 | KEAP1 (0.55) | CYP1B1STSKEAP1NFE2L2HSD17B1 | |
| SCHEMBL15036900 | 0.76 | KEAP1 (0.48) | STSKEAP1NFE2L2HSD17B1HSD17B2 | |
| SCHEMBL15244911 | 0.75 | KEAP1 (0.50) | STSKEAP1NFE2L2HSD17B1HSD17B2 |
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-2013090185-A1 | CYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | POLYMEDIX, INC. (US) | 2013-06-20 | — | — | WO | disclosed |