Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 6/20 | 0.43 |
| ▸ | PAOX | Q6QHF9 | 7/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL377237 | 0.86 | EPHX2 (0.49) | EPHX2PAOXADRA1AKDM4EMAPK1 | |
| SCHEMBL26748552 | 0.79 | PAOX (0.47) | EPHX2PAOXADRA1AKDM4EMAPK1 | |
| SCHEMBL27915728 | 0.74 | EPHX2 (0.33) | EPHX2KDM4E | |
| SCHEMBL459515 | 0.73 | EPHX2 (0.40) | EPHX2PAOXADRA1AKDM4EMAPK1 | |
| SCHEMBL373838 | 0.72 | EPHX2 (0.39) | EPHX2PAOXADRA1AKDM4EMAPK1 | |
| SCHEMBL24572062 | 0.72 | KDM4E (0.76) | PAOXADRA1AKDM4EMAPK1HIF1A | |
| SCHEMBL7046977 | 0.72 | KDM4E (0.76) | PAOXADRA1AKDM4EMAPK1HIF1A | |
| SCHEMBL17445713 | 0.72 | KDM4E (0.76) | PAOXADRA1AKDM4EMAPK1HIF1A | |
| SCHEMBL16318219 | 0.72 | KDM4E (0.76) | PAOXADRA1AKDM4EMAPK1HIF1A | |
| SCHEMBL12302053 | 0.72 | KDM4E (0.76) | PAOXADRA1AKDM4EMAPK1HIF1A |
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-103025710-A | Process for the synthesis of isothiocyanates and derivatives thereof and uses of same | AURIGA INTERNAT | 2013-04-03 | — | — | CN | disclosed |