Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | FABP7 | O15540 | 1/20 | 0.41 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19662823 | 0.88 | EPHX2 (0.63) | EPHX2KMT2AOPRD1MMP1MMP2 | |
| SCHEMBL18688054 | 0.88 | EPHX2 (0.53) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL3177417 | 0.87 | KMT2A (0.62) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL30971808 | 0.86 | EPHX2 (0.52) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL15372956 | 0.86 | EPHX2 (0.52) | EPHX2KMT2AOPRD1CASP3EPHX1 | |
| SCHEMBL2744554 | 0.86 | EPHX2 (0.52) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL31652901 | 0.86 | KMT2A (0.56) | EPHX2KMT2AOPRD1BCHEFABP7 | |
| SCHEMBL29679265 | 0.85 | KMT2A (0.53) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL30422053 | 0.85 | KMT2A (0.56) | EPHX2KMT2AOPRD1FABP7FABP5 | |
| SCHEMBL29618948 | 0.85 | KMT2A (0.53) | EPHX2KMT2AOPRD1FABP7FABP5 |
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-2017197488-A1 | LIBRARIES OF DIVERSE MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | CYCLENIUM PHARMA INC. (CA) | 2017-11-23 | — | — | WO | disclosed |