Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 6/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | TTBK1 | Q5TCY1 | 3/20 | 0.36 |
| ▸ | TTBK2 | Q6IQ55 | 3/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 2/20 | 0.34 |
| ▸ | CHUK | O15111 | 2/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | IGF1R | P08069 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14274543 | 0.72 | ADORA1 (0.51) | DYRK1AJAK2ADORA2AADORA1IKBKB | |
| SCHEMBL1057965 | 0.70 | HRH4 (0.51) | DYRK1AJAK2TTBK1TTBK2ADORA2A | |
| SCHEMBL28111580 | 0.69 | MAPK1 (0.40) | TTKJAK2MAPK8CDK8 | |
| SCHEMBL28110985 | 0.69 | CYP1A2 (0.48) | TTKDYRK1AJAK2ADORA2AADORA1 | |
| Hydrochloric Acid SCHEMBL28275524 | 0.69 | HRH4 (0.50) | DYRK1AJAK2TTBK1TTBK2ADORA2A | |
| SCHEMBL17833428 | 0.68 | ADORA2A (0.46) | ADORA2AADORA1DCPS | |
| SCHEMBL29715845 | 0.68 | APP (0.41) | DYRK1AJAK2ADORA2AADORA1CSF1R | |
| SCHEMBL28164496 | 0.68 | PDPK1 (0.51) | ADORA2AADORA1LRRK2 | |
| SCHEMBL20168171 | 0.67 | DYRK1A (0.46) | TTKDYRK1AJAK2TTBK1TTBK2 | |
| SCHEMBL18055932 | 0.67 | DYRK1A (0.46) | DYRK1AADORA2AADORA1IKBKBCHUK |
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-106061973-A | Pyrrolo [2,3-D ] pyrimidinyl, pyrrolo [2,3-B ] pyrazinyl and pyrrolo [2,3-D ] pyridylacrylamide | 辉瑞公司 | 2016-10-26 | — | — | CN | disclosed |