Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.33 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.33 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.33 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.33 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.33 |
| ▸ | BMPR2 | Q13873 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2281187 | 0.87 | IRAK4 (0.37) | HSD11B1ACVR1BMPR1BBMPR1AACVR1B | |
| SCHEMBL8178143 | 0.86 | BRD4 (0.37) | ROCK2AURKAAURKBACVR1KDR | |
| SCHEMBL2753652 | 0.74 | MAPK8 (0.45) | ROCK2AURKAAURKBHSD11B1ACVR1 | |
| SCHEMBL2753651 | 0.74 | MAPK8 (0.45) | ROCK2AURKAAURKBHSD11B1ACVR1 | |
| SCHEMBL4402809 | 0.74 | MAPK8 (0.45) | ROCK2AURKAAURKBHSD11B1ACVR1 | |
| SCHEMBL7939313 | 0.74 | BRD4 (0.36) | ROCK2HTR6MTORBRD4 | |
| SCHEMBL1798005 | 0.73 | BRD4 (0.46) | ACVR1BMPR1BBMPR1AACVR1BTGFBR1 | |
| SCHEMBL2753526 | 0.73 | PDPK1 (0.40) | ACVR1BMPR1BBMPR1AACVR1BTGFBR1 | |
| SCHEMBL2753393 | 0.72 | BRD4 (0.38) | ACVR1BMPR1BBMPR1AACVR1BTGFBR1 | |
| SCHEMBL1796224 | 0.71 | BRD4 (0.35) | HSD11B1ACVR1BMPR1BBMPR1AACVR1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010015803-A1 | DIAZAINDOLE DERIVATIVES AND THEIR USE IN THE INHIBITION OF C-JUN N-TERMINAL KINASE | EISAI R & D MANAGEMENT CO. LTD (JP) | 2010-02-11 | — | — | WO | disclosed |