Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13530249 | 0.93 | KDM4E (0.36) | ALDH1A1CXCL12ROCK2ROCK1KDM4E | |
| SCHEMBL13765102 | 0.84 | ALDH1A1 (0.39) | ALDH1A1KDM4ELMNAKMT2AMAPK1 | |
| SCHEMBL13530378 | 0.79 | KRAS (0.34) | ROCK2ROCK1KRASSOS1MAPK1 | |
| SCHEMBL13530451 | 0.79 | MAPK1 (0.39) | ROCK2ROCK1MAPK1JAK2JAK3 | |
| SCHEMBL17011483 | 0.78 | JAK2 (0.34) | KRASSOS1JAK2JAK3 | |
| SCHEMBL13529419 | 0.78 | PPARA (0.34) | KRASSOS1JAK2JAK3KDM5A | |
| SCHEMBL13765098 | 0.78 | CYP1A2 (0.41) | ALDH1A1LMNAKMT2AMAPK1MEN1 | |
| SCHEMBL13529944 | 0.77 | KRAS (0.37) | ALDH1A1KMT2AKRASSOS1JAK2 | |
| SCHEMBL13530416 | 0.77 | RORC (0.42) | ROCK2ROCK1LMNAMAPK1JAK2 | |
| SCHEMBL13765017 | 0.76 | MAOB (0.42) | ACACB |
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-2009094442-A2 | 5-FLUORO PYRIMIDINE DERIVATIVES | DOW AGROSCIENCES LLC (US) | 2009-07-30 | — | — | WO | disclosed |