Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 11/20 | 0.60 |
| ▸ | IKBKE | Q14164 | 10/20 | 0.60 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | CCNC | P24863 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.46 |
| ▸ | BMPR1B | O00238 | 2/20 | 0.45 |
| ▸ | BMPR1A | P36894 | 2/20 | 0.45 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.45 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.45 |
| ▸ | PRKCI | P41743 | 2/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21592921 | 0.88 | TBK1 (0.47) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL31536234 | 0.87 | TBK1 (0.64) | TBK1IKBKEPRKCI | |
| SCHEMBL21592923 | 0.86 | TBK1 (0.48) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL31536123 | 0.76 | TBK1 (0.44) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL31536145 | 0.75 | CCNE2 (0.44) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL14059404 | 0.75 | TBK1 (1.00) | TBK1IKBKEPRKCI | |
| SCHEMBL29727158 | 0.75 | LCK (0.56) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL28762636 | 0.75 | LCK (0.56) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL31536309 | 0.75 | CHRNA7 (0.43) | TBK1IKBKECCNE2CCNE1CDK2 | |
| SCHEMBL28499799 | 0.73 | SGK1 (0.63) | — |
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-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |