Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | RAF1 | P04049 | 6/20 | 0.41 |
| ▸ | BRAF | P15056 | 5/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.39 |
| ▸ | KIT | P10721 | 2/20 | 0.39 |
| ▸ | FLT4 | P35916 | 2/20 | 0.39 |
| ▸ | MAP3K20 | Q9NYL2 | 2/20 | 0.39 |
| ▸ | RET | P07949 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.39 |
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | MUSK | O15146 | 1/20 | 0.39 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 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 | |
|---|---|---|---|---|
| SCHEMBL245393 | 0.91 | PARP1 (0.48) | LOXL2PARP1IGF1RRAF1BRAF | |
| SCHEMBL245411 | 0.79 | PARP1 (0.50) | LOXL2PARP1IGF1RBRAFKDR | |
| SCHEMBL13945543 | 0.78 | PLK1 (0.51) | LOXL2PARP1IGF1RRAF1BRAF | |
| Hydrochloric Acid SCHEMBL245288 | 0.78 | PARP1 (0.49) | LOXL2PARP1IGF1RBRAFKDR | |
| Trifluoroacetic Acid SCHEMBL15169362 | 0.75 | KDM4C (0.42) | RAF1BRAFKDREPHX2ADORA1 | |
| Trifluoroacetic Acid SCHEMBL30663246 | 0.75 | TLR7 (0.52) | PTGS2OPRK1KMT2A | |
| SCHEMBL30542691 | 0.74 | PARP1 (0.51) | LOXL2PARP1IGF1RBRAFKDR | |
| SCHEMBL246824 | 0.74 | PARP1 (0.51) | LOXL2PARP1IGF1RBRAFKDR | |
| SCHEMBL18922125 | 0.74 | SMYD3 (0.58) | LOXL2PARP1RAF1BRAFKDR | |
| SCHEMBL19961180 | 0.74 | PARP1 (0.48) | LOXL2PARP1IGF1RRAF1BRAF |
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 |
|---|---|---|---|---|---|---|---|
| EP-2588454-A1 | SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | Bayer Intellectual Property GmbH (DE) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012000945-A1 | SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-01-05 | — | — | WO | disclosed |