Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7219387 | 0.88 | MEN1 (0.43) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL7217431 | 0.87 | SMN1; SMN2 (0.44) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL7223947 | 0.86 | SMN1; SMN2 (0.49) | SMN1; SMN2NLRP3ALDH1A1LMNAHPGD | |
| SCHEMBL7223596 | 0.86 | SMN1; SMN2 (0.43) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL7223483 | 0.84 | SMN1; SMN2 (0.48) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL7223685 | 0.81 | SMN1; SMN2 (0.50) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL27261071 | 0.81 | SMN1; SMN2 (0.47) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL7225109 | 0.77 | NPSR1 (0.49) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA | |
| SCHEMBL30502814 | 0.76 | NLRP3 (0.56) | SMN1; SMN2NLRP3ALDH1A1LMNAMAPT | |
| SCHEMBL7224731 | 0.76 | ALDH1A1 (0.53) | SMN1; SMN2NLRP3NPSR1ALDH1A1LMNA |
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-6521603-B2 | Amide, thioamide, amidine and thioester derivatives containing a benzene, pyridine, thiophene, furan, pyrrole, pyrazole, thiazole or isothiazole ring | MONSANTO TECHNOLOGY LLC | 2003-02-18 | — | — | US | claimed |