Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 5/20 | 0.58 |
| ▸ | JAK2 | O60674 | 1/20 | 0.53 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.47 |
| ▸ | FLT3 | P36888 | 2/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | INSR | P06213 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | LYN | P07948 | 1/20 | 0.47 |
| ▸ | KIT | P10721 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL265834 | 0.79 | CCNE2 (0.51) | DHFRGSK3B | |
| SCHEMBL264497 | 0.78 | NPSR1 (0.51) | DHFRCYP2C9 | |
| SCHEMBL4974791 | 0.78 | DHFR (0.47) | DHFR | |
| Pyrrolidine SCHEMBL28949357 | 0.77 | DHFR (0.52) | DHFRADORA1 | |
| SCHEMBL30488016 | 0.77 | ADORA1 (0.70) | DHFRROCK1LIMK1FGFR1FLT3 | |
| SCHEMBL1388276 | 0.77 | ADORA1 (0.70) | DHFRROCK1LIMK1FGFR1FLT3 | |
| SCHEMBL6069433 | 0.77 | RIPK2 (0.50) | JAK2LOXL2ROCK1LIMK1PTK2 | |
| SCHEMBL2437223 | 0.77 | FGFR1 (0.56) | DHFRLOXL2FGFR1EGFRFYN | |
| SCHEMBL1388358 | 0.77 | DHFR (0.71) | DHFRFGFR1MAP4K4ADORA1 | |
| SCHEMBL30401146 | 0.77 | DHFR (0.71) | DHFRFGFR1MAP4K4ADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107530430-A | AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS | 国立大学法人京都大学 | 2018-01-02 | — | — | CN | disclosed |
| CN-103626742-A | Bi-aryl meta-pyrimidine inhibitors of kinases | TARGEGEN INC | 2014-03-12 | — | — | CN | disclosed |