Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 19/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5290930 | 0.84 | FDFT1 (0.39) | GCKALDH1A1 | |
| SCHEMBL5299870 | 0.83 | KCNH3 (0.41) | ALDH1A1 | |
| SCHEMBL5289981 | 0.77 | MPO (0.42) | GCKALDH1A1 | |
| SCHEMBL5290923 | 0.76 | LOXL2 (0.40) | GCKALDH1A1 | |
| SCHEMBL5298422 | 0.76 | ALDH1A1 (0.39) | GCKALDH1A1 | |
| SCHEMBL5294263 | 0.73 | NPC1 (0.46) | RAB9A | |
| SCHEMBL5357947 | 0.71 | ALDH1A1 (0.39) | ALDH1A1RAB9A | |
| SCHEMBL5305528 | 0.71 | SMN1; SMN2 (0.44) | ALDH1A1 | |
| SCHEMBL5304439 | 0.71 | FDFT1 (0.42) | ALDH1A1 | |
| SCHEMBL5293411 | 0.70 | FDFT1 (0.41) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007012724-A1 | 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF | CYTOMICS SYSTEMS (FR) | 2007-02-01 | — | — | WO | claimed |
| WO-2007012724-A1 | 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF | CYTOMICS SYSTEMS (FR) | 2007-02-01 | — | — | WO | disclosed |