Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 11/20 | 0.60 |
| ▸ | GSK3B | P49841 | 11/20 | 0.60 |
| ▸ | CDK1 | P06493 | 10/20 | 0.60 |
| ▸ | CCNB2 | O95067 | 9/20 | 0.60 |
| ▸ | CCNB1 | P14635 | 9/20 | 0.60 |
| ▸ | CCNB3 | Q8WWL7 | 9/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 5/20 | 0.38 |
| ▸ | CDK2 | P24941 | 3/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.37 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.36 |
| ▸ | AURKA | O14965 | 2/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | PAK4 | O96013 | 2/20 | 0.36 |
| ▸ | ABL1 | P00519 | 2/20 | 0.36 |
| ▸ | FYN | P06241 | 2/20 | 0.36 |
| ▸ | RET | P07949 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2786754 | 0.82 | GSK3A (0.67) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL2787356 | 0.76 | PDE1A (0.39) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL2787754 | 0.76 | CCNB2 (0.39) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL490379 | 0.76 | GSK3A (1.00) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL490764 | 0.70 | GSK3A (1.00) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL28195540 | 0.68 | L3MBTL1 (0.47) | L3MBTL1PDE1APDE1BPDE1CSLC6A2 | |
| SCHEMBL857278 | 0.65 | CCNB2 (0.68) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL29982576 | 0.64 | PDE1A (0.45) | L3MBTL1PDE1APDE1BPDE1CKMT2A | |
| SCHEMBL29983314 | 0.63 | PDE1A (0.48) | PDE1APDE1BPDE1C | |
| SCHEMBL29983947 | 0.63 | PDE1A (0.48) | PDE1APDE1BPDE1C |
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-2010046215-A2 | DIAZA-INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2010-04-29 | — | — | WO | disclosed |