Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CASP2 | P42575 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ADH1B | P00325 | 1/20 | 0.37 |
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 SCHEMBL10937056 | 0.91 | TSHR (0.46) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL3927721 | 0.87 | — | — | |
| SCHEMBL25950295 | 0.85 | CYP2C19 (0.52) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL13469008 | 0.85 | TSHR (0.48) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL23929280 | 0.83 | CYP2C19 (0.50) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL1960042 | 0.83 | TSHR (0.46) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL16306515 | 0.83 | CYP2C19 (0.50) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| SCHEMBL13469009 | 0.83 | TSHR (0.52) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| Diethylamine SCHEMBL28163405 | 0.82 | TP53 (0.48) | TSHRCYP2C19MEN1KMT2ACYP1A2 | |
| Octadecanoic Acid Amide SCHEMBL28253450 | 0.81 | SOAT1 (0.50) | TSHRCYP2C19MEN1KMT2ACYP1A2 |
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 |