Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25779023 | 0.93 | CYP2D6 (0.39) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL6922492 | 0.90 | GAA (0.38) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL81260 | 0.81 | TSHR (0.41) | KMT2ATSHRMAOB | |
| SCHEMBL21451670 | 0.77 | CYP2D6 (0.34) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL22254744 | 0.77 | CYP2D6 (0.34) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL4550288 | 0.77 | CYP2D6 (0.38) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL4974168 | 0.75 | — | — | |
| SCHEMBL24638737 | 0.74 | HRH3 (0.36) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL21916388 | 0.74 | CYP2D6 (0.32) | CYP2D6KMT2AKDM4EGAATSHR | |
| SCHEMBL21776051 | 0.74 | CYP2D6 (0.32) | CYP2D6KMT2AKDM4EGAATSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4118134-B1 | PHOTOCHROMIC POLYDIORGANOSILOXANE VINYLIC CROSSLINKERS | ALCON INC (CH) | 2024-02-28 | — | — | EP | disclosed |
| EP-3853219-B1 | HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINE HYDRAZIDES | BAYER AG (DE) | 2023-07-12 | — | — | EP | disclosed |