Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17612855 | 0.84 | CTSB (0.52) | CTSBKEAP1ALDH1A1NPSR1MAPT | |
| SCHEMBL17612907 | 0.78 | KEAP1 (0.48) | KEAP1 | |
| SCHEMBL17612898 | 0.74 | KEAP1 (0.55) | CTSBKEAP1ALDH1A1MAPT | |
| SCHEMBL17599504 | 0.73 | KEAP1 (0.65) | KEAP1KDM4EBRD4PRKCAPRKCQ | |
| SCHEMBL17612861 | 0.70 | KEAP1 (0.54) | CTSBKEAP1ALDH1A1NPSR1MAPT | |
| SCHEMBL17612856 | 0.69 | KEAP1 (0.56) | CTSBKEAP1ALDH1A1NPSR1MAPT | |
| SCHEMBL17612906 | 0.69 | KEAP1 (0.54) | CTSBKEAP1ALDH1A1NPSR1MAPT | |
| SCHEMBL17599436 | 0.68 | KEAP1 (0.74) | CTSBKEAP1ALDH1A1NPSR1MAPT | |
| SCHEMBL19000157 | 0.65 | CTSB (0.64) | CTSBALDH1A1NPSR1MAPTKMT2A | |
| SCHEMBL17599448 | 0.65 | KEAP1 (0.73) | CTSBKEAP1ALDH1A1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2997966-A1 | Naphthyl Sulfonamide Pyrrolidine Derivatives as KEAP-1 Modulators for the Treatment of Diabetes, Obesity, Dyslipidemia and Related Disorders | SANOFI (FR) | 2016-03-23 | — | — | EP | disclosed |