Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 2/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2247894 | 0.95 | ALDH1A1 (0.40) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL9316178 | 0.92 | ALDH1A1 (0.38) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| Methacrylic Acid SCHEMBL10842460 | 0.88 | ALDH1A1 (0.38) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL11139673 | 0.87 | ALDH1A1 (0.34) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL31195673 | 0.86 | ALDH1A1 (0.39) | ALDH1A1KDM4EHSD17B10SMN1; SMN2TSHR | |
| SCHEMBL4649144 | 0.85 | L3MBTL1 (0.37) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL6473086 | 0.85 | TSHR (0.36) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL3946616 | 0.84 | KDM4E (0.39) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL6473509 | 0.83 | ALDH1A1 (0.38) | ALDH1A1KDM4ENPSR1HSD17B10LMNA | |
| SCHEMBL7206294 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5250641-A | Using morpholine derivative, pyrimidinetrione compound, organometallics and organohalogens as aids, promoters for (meth) acrylate polymers | GC DENTAL PRODUCTS CORP. (JP) | 1993-10-05 | — | — | US | disclosed |