Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Butyramide SCHEMBL28820280 | 0.83 | NR3C1 (0.49) | NR3C1ALDH1A1HTTCYP1A2CYP3A4 | |
| SCHEMBL28820283 | 0.82 | MAPT (0.60) | MAPTALDH1A1HTTLMNAALOX15 | |
| SCHEMBL29407201 | 0.77 | NR3C1 (0.68) | NR3C1ALDH1A1HTTLMNAALOX15 | |
| SCHEMBL5945125 | 0.77 | NR3C1 (0.68) | NR3C1ALDH1A1HTTLMNAALOX15 | |
| Hydrochloric Acid SCHEMBL11059615 | 0.76 | NR3C1 (0.67) | NR3C1ALDH1A1HTTLMNAALOX15 | |
| SCHEMBL28974174 | 0.75 | NR3C1 (0.65) | NR3C1ALDH1A1HTTLMNAALOX15 | |
| SCHEMBL30280484 | 0.75 | NR3C1 (0.65) | NR3C1ALDH1A1HTTLMNAALOX15 | |
| SCHEMBL28820273 | 0.74 | CA12 (0.41) | NR3C1ALDH1A1TP53GRIN1GRIN2B | |
| SCHEMBL11439452 | 0.72 | NR3C1 (0.55) | NR3C1ALDH1A1HTTLMNAHSD17B10 | |
| SCHEMBL11569941 | 0.71 | NR3C1 (0.47) | NR3C1ALDH1A1HTTLMNACYP3A4 |
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-114773289-A | Nitrobenzoisothiazole azo compound and application thereof | 辽宁庸信达染料化工有限公司 | 2022-07-22 | — | — | CN | disclosed |