Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL30850082 | 0.90 | NPC1 (0.48) | KDM4ESMN1; SMN2MAPTKMT2AALOX15 | |
| SCHEMBL30159083 | 0.90 | KDM4E (0.42) | GABRA5KDM4EGAASMN1; SMN2MAPT | |
| SCHEMBL30159062 | 0.84 | CYP11B1 (0.39) | GRM5GABRA5KDM4EGAASMN1; SMN2 | |
| SCHEMBL30158931 | 0.75 | JMJD6 (0.36) | KMT2ANPC1MEN1RAB9ATRPV4 | |
| SCHEMBL15173149 | 0.72 | KDM4E (0.56) | GRM5KDM4ESMN1; SMN2MAPTALOX15 | |
| SCHEMBL475480 | 0.72 | AXL (0.56) | GRM5GABRA5KDM4EGAAMAPT | |
| SCHEMBL989567 | 0.72 | AXL (0.56) | GRM5GABRA5KDM4EGAAMAPT | |
| SCHEMBL23971164 | 0.72 | LMNA (0.42) | GRM5GABRA5KDM4EGAAMAPT | |
| SCHEMBL30158919 | 0.69 | KDM4E (0.42) | KDM4EGAASMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL30159114 | 0.69 | AKT1 (0.46) | GRM5KDM4EGAASMN1; SMN2MAPT |
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-115551862-B | Macrocyclic inhibitors of peptidyl arginine deiminase | 吉利德科学公司 | 2024-04-12 | — | — | CN | disclosed |