Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 5/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL45804 | 0.87 | HMGCR (0.62) | HMGCRNR1I2GAAKMT2AMEN1 | |
| Calcium SCHEMBL30510960 | 0.86 | HMGCR (0.61) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL28422669 | 0.86 | HMGCR (0.61) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL7156553 | 0.86 | HMGCR (0.61) | HMGCRNR1I2GAAKMT2AMEN1 | |
| Potassium SCHEMBL4892236 | 0.86 | HMGCR (0.61) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL225937 | 0.86 | HMGCR (0.61) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL4689967 | 0.85 | HMGCR (0.46) | HMGCRNR1I2GAAKMT2AMEN1 | |
| Calcium SCHEMBL7116377 | 0.84 | HMGCR (0.44) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL340446 | 0.84 | HMGCR (0.44) | HMGCRNR1I2GAAKMT2AMEN1 | |
| SCHEMBL15051658 | 0.77 | HMGCR (0.54) | HMGCRNR1I2GAAKMT2AMEN1 |
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-2024090855-A1 | ISOCYANATE COMPOSITION | 한화솔루션 주식회사 | 2024-05-02 | — | — | WO | disclosed |