Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29001186 | 0.82 | ERN1 (0.55) | ERN1MEN1KMT2AKDM4ENPC1 | |
| SCHEMBL29001197 | 0.81 | ERN1 (0.52) | ERN1MEN1KMT2AKDM4ENPC1 | |
| Salicyladehyde SCHEMBL29001184 | 0.78 | TRIM24 (0.49) | ERN1MEN1KMT2AKDM4ENPC1 | |
| 5-Bromosalicylaldehyde SCHEMBL28644651 | 0.77 | ERN1 (0.54) | ERN1MEN1KMT2AKDM4ENPC1 | |
| SCHEMBL7966560 | 0.76 | ERN1 (0.61) | ERN1MEN1KMT2AKDM4ENPC1 | |
| SCHEMBL31205727 | 0.74 | — | — | |
| SCHEMBL29382880 | 0.74 | ERN1 (1.00) | ERN1MEN1KMT2AKDM4ETDP1 | |
| SCHEMBL294059 | 0.74 | ERN1 (1.00) | ERN1MEN1KMT2AKDM4ETDP1 | |
| SCHEMBL1782191 | 0.74 | — | — | |
| SCHEMBL29001176 | 0.74 | ERN1 (0.57) | ERN1KDM4ENPC1TDP1L3MBTL1 |
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-113583028-B | High cancer cell selectivity anticancer medicine based on metal organic complex and preparation method thereof | 广东石油化工学院 | 2023-05-12 | — | — | CN | disclosed |