Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.55 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | CCNK | O75909 | 1/20 | 0.42 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.41 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.41 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1808527 | 0.90 | NPC1 (0.53) | HSP90AA1HSP90AB1CCNKCDK12NPC1 | |
| SCHEMBL1734185 | 0.89 | CYP19A1 (0.51) | CCNKCDK12CYP19A1MEN1KMT2A | |
| SCHEMBL1813784 | 0.88 | CYP19A1 (0.52) | CCNKCDK12NPC1RAB9ACYP19A1 | |
| SCHEMBL1816497 | 0.88 | TEK (0.43) | CCNKCDK12NPC1RAB9ACYP19A1 | |
| SCHEMBL1806051 | 0.87 | EPHB4 (0.45) | CCNKCDK12NPC1RAB9ACYP19A1 | |
| SCHEMBL1812647 | 0.85 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1CCNKCDK12NPC1 | |
| SCHEMBL1816014 | 0.84 | CCNK (0.47) | HSP90AA1HSP90AB1CCNKCDK12NPC1 | |
| SCHEMBL1805271 | 0.84 | CCNK (0.56) | HSP90AA1HSP90AB1CCNKCDK12NPC1 | |
| SCHEMBL1809812 | 0.83 | CD74 (0.53) | CCNKCDK12NPC1RAB9ACYP19A1 | |
| SCHEMBL1806532 | 0.83 | KDR (0.47) | CCNKCDK12NPC1RAB9ACYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011051198-A2 | PYRIDINE DERIVATIVES AS AGRICULTURAL PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2011-05-05 | — | — | WO | claimed |
| WO-2011051198-A2 | PYRIDINE DERIVATIVES AS AGRICULTURAL PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2011-05-05 | — | — | WO | disclosed |