Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.32 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL23795191 | 1.00 | HPGD (0.38) | HPGDCYP1A2CYP3A4CYP2C19LTA4H | |
| SCHEMBL31532186 | 0.87 | L3MBTL1 (0.34) | HPGDCYP1A2CYP3A4CYP2C19BRD4 | |
| SCHEMBL16915398 | 0.87 | L3MBTL1 (0.34) | HPGDCYP1A2CYP3A4CYP2C19BRD4 | |
| SCHEMBL24107537 | 0.83 | LTA4H (0.37) | LTA4HKCNH2CCR2PTGER4CHRNB2 | |
| SCHEMBL23795203 | 0.82 | HPGD (0.39) | HPGDCYP1A2CYP3A4CYP2C19LTA4H | |
| SCHEMBL31149034 | 0.82 | HPGD (0.39) | HPGDCYP1A2CYP3A4CYP2C19LTA4H | |
| SCHEMBL24786963 | 0.78 | HDAC1 (0.35) | MAPTTP53 | |
| SCHEMBL20558343 | 0.76 | KMT2A (0.36) | HPGDCYP1A2CYP3A4CYP2C19BRD4 | |
| SCHEMBL24786950 | 0.76 | KDR (0.37) | MAPTTP53MAP4K1 | |
| SCHEMBL24786580 | 0.76 | ALOX5AP (0.35) | — |
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-112996780-B | Herbicidal compounds | 先正达农作物保护股份公司 | 2024-11-08 | — | — | CN | disclosed |