Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDT | P30046 | 2/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 14/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4778554 | 0.90 | DDT (0.42) | DDTNR1I2 | |
| SCHEMBL4779210 | 0.88 | TEK (0.41) | DDTNR1I2 | |
| SCHEMBL4784000 | 0.85 | DDT (0.34) | DDT | |
| SCHEMBL4782663 | 0.85 | MAPK14 (0.38) | DDT | |
| SCHEMBL4779770 | 0.83 | NR1H4 (0.39) | DDTNR1I2 | |
| SCHEMBL4782092 | 0.83 | BRAF (0.34) | DDTRAB9ATP53 | |
| SCHEMBL4730805 | 0.83 | DDT (0.42) | DDT | |
| SCHEMBL4780132 | 0.82 | RAF1 (0.40) | — | |
| SCHEMBL4783784 | 0.81 | TEK (0.40) | DDTNR1I2 | |
| SCHEMBL4780945 | 0.81 | DDT (0.33) | DDTNR1I2NPC1ALDH1A1PKM |
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-2008021388-A1 | HETEROARYL DERIVATIVES AS CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2008-02-21 | — | — | WO | disclosed |