Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.49 |
| ▸ | JAK2 | O60674 | 4/20 | 0.47 |
| ▸ | JAK1 | P23458 | 3/20 | 0.47 |
| ▸ | RBP4 | P02753 | 1/20 | 0.46 |
| ▸ | FADS1 | O60427 | 1/20 | 0.45 |
| ▸ | F7 | P08709 | 1/20 | 0.45 |
| ▸ | F3 | P13726 | 1/20 | 0.45 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.44 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.42 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.42 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL570293 | 0.88 | PRKAG1 (0.55) | ROCK1F7F3MAP2K4PRKAG1 | |
| SCHEMBL17324736 | 0.86 | ROCK1 (0.47) | ROCK1JAK2JAK1RBP4FADS1 | |
| SCHEMBL16246796 | 0.86 | JAK2 (0.48) | ROCK1JAK2JAK1RBP4FADS1 | |
| SCHEMBL19997303 | 0.82 | PAK1 (0.64) | ROCK1JAK2JAK1RBP4FADS1 | |
| SCHEMBL22518544 | 0.82 | ROCK1 (0.53) | ROCK1JAK2JAK1DYRK1ARIPK1 | |
| SCHEMBL17321393 | 0.82 | DYRK1A (0.48) | ROCK1JAK2JAK1RBP4DYRK1A | |
| SCHEMBL4793264 | 0.82 | KDM4E (0.63) | ROCK1JAK2JAK1MAP2K4DYRK1A | |
| SCHEMBL20839333 | 0.80 | F7 (0.47) | ROCK1JAK2JAK1FADS1F7 | |
| SCHEMBL17608646 | 0.80 | MAP2K4 (0.50) | JAK2JAK1MAP2K4PRKAG1PRKAA1 | |
| SCHEMBL15253767 | 0.79 | RBP4 (0.46) | RBP4MAP2K4DYRK1APRKAG1PRKAA1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102558074-B | Piperazine amide compound containing pyridazine substituent group | GUANGZHOU INST BIOMED & HEALTH | 2014-09-24 | — | — | CN | disclosed |
| CN-102382102-B | Amide compound | GUANGZHOU INST BIOMED & HEALTH | 2014-01-08 | — | — | CN | disclosed |
| CN-101851211-B | Piperazine amide compound | JIANGSU CHIA TAI TIANQING PHAR | 2013-08-14 | — | — | CN | disclosed |
| CN-102558074-A | Piperazine amide compound containing pyridazine substituent group | GUANGZHOU INST BIOMED & HEALTH | 2012-07-11 | — | — | CN | disclosed |
| CN-102382102-A | Amide compound | GUANGZHOU INST BIOMED & HEALTH | 2012-03-21 | — | — | CN | disclosed |
| CN-101851211-A | Novel piperazine amide compound | JIANGSU CHIA TAI TIANQING PHAR | 2010-10-06 | — | — | CN | disclosed |