Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 9/20 | 0.44 |
| ▸ | CASP2 | P42575 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL28824126 | 0.98 | EPHX1 (0.46) | EPHX1CASP2CNR2FAAHZDHHC20 | |
| SCHEMBL27546682 | 0.82 | KDM4C (0.35) | EPHX1CNR2 | |
| SCHEMBL28184077 | 0.81 | PAOX (0.46) | — | |
| SCHEMBL23001151 | 0.81 | EPHX1 (0.55) | EPHX1FAAH | |
| SCHEMBL23001139 | 0.81 | EPHX1 (0.55) | EPHX1FAAH | |
| SCHEMBL25328102 | 0.81 | TDP1 (0.33) | CNR2FAAH | |
| SCHEMBL14378864 | 0.81 | PAOX (0.46) | — | |
| Hydrochloric Acid SCHEMBL9119586 | 0.81 | EPHX1 (0.41) | EPHX1CASP2CNR2FAAHZDHHC20 | |
| SCHEMBL27991126 | 0.79 | EPHX1 (0.42) | EPHX1CASP2CNR2FAAHZDHHC20 | |
| Ammonia Solution, Strong SCHEMBL28252711 | 0.79 | FAAH (0.50) | EPHX1CASP2CNR2FAAHZDHHC20 |
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-106117213-A | Heteroaryl compound and synthesis thereof and purification process | 西格诺药品有限公司 | 2016-11-16 | — | — | CN | disclosed |