Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSF1 | Q00613 | 14/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9426852 | 1.00 | HSF1 (0.60) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| Maleic Acid SCHEMBL3066517 | 0.92 | HSF1 (0.52) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| Fumaric Acid SCHEMBL3066521 | 0.92 | HSF1 (0.52) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| Maleic Acid SCHEMBL3066519 | 0.92 | HSF1 (0.52) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL6009203 | 0.82 | HSF1 (0.65) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL6009202 | 0.82 | HSF1 (0.65) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| Hydrochloric Acid SCHEMBL3076169 | 0.81 | HSF1 (0.64) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| Hydrochloric Acid SCHEMBL3076170 | 0.81 | HSF1 (0.64) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL3060503 | 0.80 | HSF1 (0.60) | HSF1CYP2D6TSHRHIF1AKDM4E | |
| SCHEMBL3060495 | 0.80 | HSF1 (0.60) | HSF1CYP2D6TSHRHIF1AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5328906-A | 0-(3-amino-2-hydroxypropyl)-hydroximic acid halides and process for preparing the same | BIOREX KUTATO-FEJLESZTO KFT (HU) | 1994-07-12 | — | — | US | disclosed |