Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 5/20 | 0.40 |
| ▸ | SOD1 | P00441 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | S100A9 | P06702 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
| ▸ | FLT4 | P35916 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | VEGFA | P15692 | 1/20 | 0.31 |
| ▸ | EPAS1 | Q99814 | 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 | |
|---|---|---|---|---|
| SCHEMBL2055459 | 0.78 | ACLY (0.44) | ACLYCNR1S100A9VCAM1FLT1 | |
| SCHEMBL14450607 | 0.74 | CTSG (0.45) | ACLYRORCMAPT | |
| SCHEMBL633226 | 0.70 | TSHR (0.50) | VCAM1 | |
| SCHEMBL5852713 | 0.70 | VCAM1 (0.43) | VCAM1 | |
| SCHEMBL31208000 | 0.69 | NAMPT (0.45) | ACLY | |
| SCHEMBL1791387 | 0.69 | ACLY (0.47) | ACLYCNR1MAPTCNR2FLT1 | |
| SCHEMBL3242209 | 0.68 | SOD1 (0.43) | ACLYSOD1CNR1CNR2FLT1 | |
| SCHEMBL18332339 | 0.67 | CYP1A2 (0.48) | MAPT | |
| SCHEMBL16235280 | 0.67 | S100A9 (0.45) | ACLYCNR1RORCS100A9MAPT | |
| SCHEMBL31646966 | 0.66 | ACLY (0.51) | ACLYCNR1CNR2 |
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-2016204261-A1 | AMINOPYRAZOLE DERIVATIVES | 中外製薬株式会社 | 2016-12-22 | — | — | WO | disclosed |