Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30184938 | 0.91 | GAA (0.50) | GAAMAPTTSHRTDP1CYP3A4 | |
| SCHEMBL95180 | 0.78 | CYP3A4 (0.58) | GAAMAPTALOX5PTGS2TSHR | |
| Hydrochloric Acid SCHEMBL4929431 | 0.76 | CYP3A4 (0.55) | GAAMAPTALOX5PTGS2TSHR | |
| SCHEMBL24701452 | 0.73 | GAA (0.46) | GAAMAPTTSHRTDP1CYP3A4 | |
| SCHEMBL18751508 | 0.73 | GAA (0.46) | GAAMAPTALOX5PTGS2TSHR | |
| SCHEMBL13963710 | 0.73 | PTGS2 (0.50) | GAAMAPTALOX5PTGS2TSHR | |
| SCHEMBL26467101 | 0.73 | GAA (0.46) | GAAMAPTTSHRTDP1CYP3A4 | |
| SCHEMBL632547 | 0.72 | THRB (0.50) | GAAMAPTTSHRTDP1CYP3A4 | |
| SCHEMBL21695780 | 0.72 | GAA (0.50) | GAAMAPTALOX5PTGS2TSHR | |
| SCHEMBL11589642 | 0.72 | MAPT (0.50) | GAAMAPTTSHRTDP1CYP3A4 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110698352-B | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2023-01-17 | — | — | CN | claimed |
| CN-110698352-A | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2020-01-17 | — | — | CN | claimed |
| CN-110698352-B | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2023-01-17 | — | — | CN | disclosed |
| CN-110698352-B | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2023-01-17 | — | — | CN | disclosed |
| CN-110698352-B | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2023-01-17 | — | — | CN | disclosed |
| CN-110698352-A | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2020-01-17 | — | — | CN | disclosed |
| CN-110698352-A | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2020-01-17 | — | — | CN | disclosed |
| CN-110698352-A | Synthetic method of 3-bromo-5-aminocatechol dimethyl ether | 邢台学院 | 2020-01-17 | — | — | CN | disclosed |