Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.42 |
| ▸ | KDM6B | O15054 | 1/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | KDM5C | P41229 | 1/20 | 0.42 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.42 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 2/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30850116 | 0.90 | GRM5 (0.42) | KDM4EKDM4CKDM6BKDM5CKDM2A | |
| SCHEMBL30850082 | 0.87 | NPC1 (0.48) | KDM4ESMN1; SMN2NPC1KMT2AMEN1 | |
| SCHEMBL30159062 | 0.75 | CYP11B1 (0.39) | KDM4EGAASMN1; SMN2TP53NPC1 | |
| SCHEMBL30158931 | 0.72 | JMJD6 (0.36) | KDM5ANPC1KMT2AMEN1RAB9A | |
| SCHEMBL23971162 | 0.71 | KDM5A (0.38) | KDM4EKDM4CKDM5AKDM5BKMT2A | |
| SCHEMBL18311298 | 0.69 | KAT6A (0.64) | KDM4EKDM4CKDM6BKDM4AKDM5C | |
| SCHEMBL29642392 | 0.68 | KDM5A (0.43) | KDM4CKDM5AKDM5B | |
| SCHEMBL28830424 | 0.67 | KDM4E (0.64) | KDM4EKDM4CKDM6BKDM4AKDM5C | |
| SCHEMBL863317 | 0.67 | KDM4E (0.74) | KDM4EKDM4CKDM6BKDM4AKDM5C | |
| SCHEMBL28404844 | 0.67 | KDM4E (0.64) | KDM4EKDM4CKDM6BKDM4AKDM5C |
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 |
|---|---|---|---|---|---|---|---|
| CN-115551862-B | Macrocyclic inhibitors of peptidyl arginine deiminase | 吉利德科学公司 | 2024-04-12 | — | — | CN | disclosed |
| CN-115551862-A | Macrocyclic inhibitors of peptidyl arginine deiminase | 吉利德科学公司 | 2022-12-30 | — | — | CN | disclosed |