Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.48 |
| ▸ | P4HTM | Q9NXG6 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL9517068 | 0.92 | CASP3 (0.47) | CASP3P4HTMSMN1; SMN2PTGS2HTT | |
| SCHEMBL9516171 | 0.88 | SMN1; SMN2 (0.46) | CASP3P4HTMSMN1; SMN2MEN1KMT2A | |
| SCHEMBL9519106 | 0.88 | EGFR (0.50) | P4HTMPTGS2PTGS1EGFR | |
| SCHEMBL9519516 | 0.86 | HTT (0.60) | CASP3P4HTMHTT | |
| SCHEMBL27379257 | 0.85 | P4HTM (0.50) | CASP3P4HTMPTGS2PTGS1EGFR | |
| SCHEMBL8869795 | 0.84 | P4HTM (0.51) | CASP3P4HTMSMN1; SMN2HTTNAMPT | |
| SCHEMBL9140003 | 0.83 | P4HTM (0.52) | CASP3P4HTMSMN1; SMN2PTGS2HTT | |
| SCHEMBL9517927 | 0.82 | P4HTM (0.42) | CASP3P4HTMPTGS2 | |
| SCHEMBL9018408 | 0.81 | SMN1; SMN2 (0.46) | CASP3P4HTMSMN1; SMN2PTGS2HTT | |
| SCHEMBL9139358 | 0.81 | P4HTM (0.50) | CASP3P4HTMSMN1; SMN2PTGS2HTT |
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-0567997-A1 | 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-11-03 | — | — | EP | disclosed |