Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 3/20 | 0.49 |
| ▸ | IL6 | P05231 | 3/20 | 0.49 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | MAX | P61244 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14760982 | 0.79 | MIF (0.41) | NFKB1MEN1ALDH1A1KMT2ANPSR1 | |
| SCHEMBL14119823 | 0.66 | TNF (1.00) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL14119825 | 0.66 | TNF (1.00) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL27967110 | 0.66 | TNF (0.71) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL8122478 | 0.66 | TNF (0.71) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL7651444 | 0.66 | TNF (0.66) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL6959499 | 0.66 | — | — | |
| SCHEMBL28811728 | 0.65 | TNF (0.74) | TNFIL6CYP24A1MYCMAX | |
| SCHEMBL28354128 | 0.65 | TNF (0.74) | TNFIL6CYP24A1MYCMAX | |
| Hydrochloric Acid SCHEMBL27967262 | 0.65 | TNF (0.69) | TNFIL6CYP24A1MYCMAX |
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-0002208-A1 | Nitro 1,4-dihydropyridines, medicaments containing them and their manufacture | BAYER AG (DE) | 1979-06-13 | — | — | EP | disclosed |