Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 7/20 | 0.43 |
| ▸ | CD14 | P08571 | 7/20 | 0.43 |
| ▸ | LY96 | Q9Y6Y9 | 7/20 | 0.43 |
| ▸ | THRA | P10827 | 4/20 | 0.42 |
| ▸ | THRB | P10828 | 4/20 | 0.42 |
| ▸ | GSTA1 | P08263 | 4/20 | 0.42 |
| ▸ | GSTP1 | P09211 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL14353074 | 1.00 | TLR4 (0.43) | TLR4CD14LY96THRATHRB | |
| SCHEMBL5021866 | 0.82 | GSTA1 (0.51) | TLR4CD14LY96GSTA1GSTP1 | |
| SCHEMBL6067586 | 0.78 | TLR4 (0.42) | TLR4CD14LY96THRATHRB | |
| SCHEMBL9786146 | 0.78 | THRB (0.59) | THRATHRBMEN1ALDH1A1POLB | |
| SCHEMBL23931194 | 0.77 | GSTA1 (0.58) | TLR4CD14LY96GSTA1GSTP1 | |
| SCHEMBL8933958 | 0.76 | SMN1; SMN2 (0.45) | THRATHRBMEN1ALDH1A1POLB | |
| SCHEMBL30702676 | 0.76 | GSTA1 (0.57) | TLR4CD14LY96GSTA1GSTP1 | |
| SCHEMBL6067606 | 0.76 | GSTA1 (0.57) | TLR4CD14LY96GSTA1GSTP1 | |
| SCHEMBL14353332 | 0.75 | GSTA1 (0.47) | TLR4CD14LY96THRATHRB | |
| SCHEMBL13062423 | 0.74 | CCNB2 (0.46) | THRATHRBMEN1ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-20130004885-A1 | FUEL CELL ELECTRODES | ENERGY, UNITED STATES DEPARTMENT OF | 2013-01-03 | — | — | US | disclosed |
| WO-2006056182-A1 | NOVEL ACTIVE SUBSTANCES FOR TREATING, DIAGNOSING AND PREVENTING MACULAR DEGENERATION | PHILIPPS-UNIVERSITÄT MARBURG (DE) | 2006-06-01 | — | — | WO | disclosed |