Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 4/20 | 0.64 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.49 |
| ▸ | AXL | P30530 | 2/20 | 0.41 |
| ▸ | CCNK | O75909 | 3/20 | 0.39 |
| ▸ | CDK12 | Q9NYV4 | 3/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 4/20 | 0.37 |
| ▸ | CHUK | O15111 | 4/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | PAK4 | O96013 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27870995 | 0.82 | PRKCI (0.66) | PRKCINUDT1AXLIKBKBCHUK | |
| SCHEMBL99690 | 0.80 | PRKCI (1.00) | PRKCINUDT1AXLCCNKCDK12 | |
| SCHEMBL29431169 | 0.80 | PRKCI (1.00) | PRKCINUDT1AXLCCNKCDK12 | |
| Ethoxycarbonyl Group SCHEMBL27870071 | 0.74 | LOXL2 (0.39) | — | |
| Ethoxycarbonyl Group SCHEMBL27518656 | 0.74 | NUDT1 (0.62) | NUDT1AXLAURKBPRKD3MAP4K4 | |
| Ethoxycarbonyl Group SCHEMBL27554420 | 0.72 | BRD4 (0.35) | NUDT1AXLBRD4 | |
| SCHEMBL2992617 | 0.69 | NUDT1 (0.55) | PRKCINUDT1AXLCCNKCDK12 | |
| SCHEMBL239630 | 0.69 | NUDT1 (0.54) | PRKCINUDT1AXLCCNKCDK12 | |
| Ethoxycarbonyl Group SCHEMBL27699034 | 0.69 | CCNT1 (0.43) | PRKCICHUKPRKD3IGF1RKDR | |
| Ethoxycarbonyl Group SCHEMBL28952732 | 0.67 | KDM4E (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106459044-A | Tank-binding kinase inhibitor compounds | 吉利德科学公司 | 2017-02-22 | — | — | CN | disclosed |