Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.30 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21584477 | 0.82 | ALDH1A1 (0.41) | ALDH1A1MEN1MAPTKMT2AGAA | |
| SCHEMBL21584403 | 0.82 | HTT (0.32) | MEP1B | |
| SCHEMBL21584337 | 0.81 | LMNA (0.41) | ALDH1A1NPSR1MEN1MAPTKMT2A | |
| SCHEMBL21584404 | 0.80 | CYP1A2 (0.36) | PDE10AALDH1A1NPSR1MEN1MAPT | |
| SCHEMBL1654721 | 0.80 | CYP1A2 (0.43) | ALDH1A1NPSR1MEN1MAPTKMT2A | |
| SCHEMBL21584383 | 0.80 | SLC26A6 (0.36) | PDE10AALDH1A1NPSR1MEN1MAPT | |
| SCHEMBL21584392 | 0.80 | ABL1 (0.35) | PDE10AALDH1A1NPSR1MEN1MAPT | |
| SCHEMBL21584408 | 0.79 | LMNA (0.43) | ALDH1A1NPSR1MEN1MAPTKMT2A | |
| SCHEMBL21584389 | 0.79 | CYP1A2 (0.36) | ALDH1A1NPSR1MEN1MAPTKMT2A | |
| SCHEMBL21584416 | 0.77 | ACP1 (0.35) | ALDH1A1MEN1MAPTKMT2AGAA |
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-2019227771-A1 | SUBSTITUTED PYRIMIDINE-4-FORMIC ACID DERIVATIVE, HERBICIDAL COMPOSITION AND USE THEREOF | 青岛清原化合物有限公司 (CN) | 2019-12-05 | — | — | WO | disclosed |