Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.79 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.61 |
| ▸ | IKBKB | O14920 | 9/20 | 0.51 |
| ▸ | CHUK | O15111 | 8/20 | 0.51 |
| ▸ | PLK4 | O00444 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 1/20 | 0.45 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | LTK | P29376 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.45 |
| ▸ | FLT3 | P36888 | 1/20 | 0.45 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.45 |
| ▸ | PRKX | P51817 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL27734073 | 1.00 | PDPK1 (0.79) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Trifluoroacetic Acid SCHEMBL29782684 | 1.00 | PDPK1 (0.79) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| SCHEMBL1651352 | 0.89 | PDPK1 (1.00) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| SCHEMBL29567411 | 0.89 | PDPK1 (1.00) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Hydrochloric Acid SCHEMBL3796059 | 0.87 | PDPK1 (0.96) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Hydrochloric Acid SCHEMBL27785396 | 0.87 | PDPK1 (0.96) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Ammonia Solution, Strong SCHEMBL28335890 | 0.87 | PDPK1 (0.96) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Hydrochloric Acid SCHEMBL28321281 | 0.87 | PDPK1 (0.96) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| SCHEMBL8593485 | 0.83 | PDPK1 (0.81) | PDPK1KEAP1IKBKBCHUKPLK4 | |
| Fumaric Acid SCHEMBL5238696 | 0.83 | PDPK1 (0.81) | PDPK1KEAP1IKBKBCHUKPLK4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101247804-B | chemical compound | SMITHKLINE BEECHAM CORP | 2012-09-26 | — | — | CN | disclosed |
| CN-101247804-A | chemical compound | SMITHKLINE BEECHAM CORP (US) | 2008-08-20 | — | — | CN | disclosed |
| EP-1948187-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2008-07-30 | — | — | EP | disclosed |
| EP-1896014-A2 | CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007062318-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-05-31 | — | — | WO | disclosed |
| WO-2007005534-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-01-11 | — | — | WO | disclosed |