Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 5/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1358529 | 0.83 | ALDH1A1 (0.49) | TAS2R14G6PDCASP7CASP6FABP4 | |
| SCHEMBL400732 | 0.82 | TAS2R14 (0.47) | TAS2R14FABP4ALDH1A1HPGDMEN1 | |
| SCHEMBL30462474 | 0.79 | TAS2R14 (0.55) | TAS2R14G6PDCASP7CASP6FABP4 | |
| SCHEMBL158167 | 0.77 | G6PD (0.55) | TAS2R14G6PDCASP7CASP6FABP4 | |
| Hydrochloric Acid SCHEMBL11631331 | 0.76 | G6PD (0.53) | TAS2R14G6PDCASP7CASP6FABP4 | |
| SCHEMBL9851131 | 0.75 | G6PD (0.65) | G6PDCASP7CASP6ALDH1A1HPGD | |
| SCHEMBL4249360 | 0.74 | ALDH1A1 (0.51) | TAS2R14G6PDCASP7CASP6CFTR | |
| SCHEMBL9892670 | 0.72 | P2RX7 (0.40) | PARP1ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL17744802 | 0.72 | G6PD (0.61) | G6PDCASP7CASP6ALDH1A1HPGD | |
| SCHEMBL4865222 | 0.71 | UCHL1 (0.50) | TAS2R14G6PDCASP7CASP6FABP4 |
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-112745237-B | 2-arylamine compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2023-06-20 | — | — | CN | disclosed |