Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | MDH1 | P40925 | 9/20 | 0.36 |
| ▸ | MDH2 | P40926 | 9/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
| ▸ | APAF1 | O14727 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | FYN | P06241 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10609700 | 0.80 | CYP3A4 (0.50) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL10791936 | 0.79 | ACACB (0.38) | SMN1; SMN2ALDH1A1MAPTPTGS1KDM4E | |
| SCHEMBL11446127 | 0.77 | ALDH1A1 (0.41) | ALDH1A1SLC6A4TDP1 | |
| SCHEMBL8847332 | 0.77 | SIGMAR1 (0.41) | CYP3A4SMN1; SMN2ALDH1A1LMNACYP2D6 | |
| SCHEMBL10612284 | 0.77 | CYP3A4 (0.50) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL6271431 | 0.77 | MTNR1A (0.46) | LMNAPTGS1 | |
| SCHEMBL21595669 | 0.77 | MTNR1A (0.46) | LMNAPTGS1 | |
| SCHEMBL21601442 | 0.77 | MTNR1A (0.46) | LMNAPTGS1 | |
| SCHEMBL18844500 | 0.76 | CYP3A4 (0.54) | CYP3A4SMN1; SMN2SHBGMDH1MDH2 | |
| SCHEMBL10789374 | 0.76 | MMP1 (0.33) | SMN1; SMN2KMT2AALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1988003756-A1 | AMINO-ALKYLATED HYDROXY COMPOUNDS AND THEIR USE AS FUNGICIDES | A/S CHEMINOVA (DK) | 1988-06-02 | — | — | WO | disclosed |