Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9429230 | 0.89 | MAPT (0.54) | NPSR1MAPTCYP3A4HSD17B10LMNA | |
| SCHEMBL10523964 | 0.87 | NPSR1 (0.86) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL30145137 | 0.87 | NPSR1 (0.86) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL1922070 | 0.87 | NPSR1 (0.86) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL29650380 | 0.87 | NPSR1 (0.86) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL1009206 | 0.87 | NPSR1 (0.86) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL10755679 | 0.86 | NPSR1 (0.64) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL9158496 | 0.84 | NPSR1 (0.82) | NPSR1MAPTHTTCYP1A2CYP3A4 | |
| Benzene SCHEMBL7148507 | 0.84 | KMT2A (0.50) | NPSR1MAPTCYP1A2HSD17B10LMNA | |
| Water SCHEMBL8601146 | 0.84 | NPSR1 (0.82) | NPSR1MAPTHTTCYP1A2CYP3A4 |
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-6218576-B1 | CONDENSING ARYLAMINE IN PRESENCE OF ANHYDROUS ALUMINUM CHLORIDE AND CALCIUM CHLORIDE; ARYLATION | SANKIO CHEMICAL CO., LTD. (JP) | 2001-04-17 | — | — | US | disclosed |