Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.59 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.59 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.57 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ABAT | P80404 | 1/20 | 0.41 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29131801 | 0.84 | KEAP1 (0.57) | ESR1ESR2KEAP1TRPA1ABAT | |
| SCHEMBL3926343 | 0.83 | KEAP1 (0.67) | ESR1ESR2KEAP1EGFRERBB2 | |
| SCHEMBL11744689 | 0.83 | POLB (0.41) | ESR1ESR2KEAP1TRPA1ATM | |
| SCHEMBL1276090 | 0.81 | CALM1 (0.48) | ESR1ESR2 | |
| SCHEMBL3306785 | 0.80 | ESR1 (0.47) | ESR1ESR2TRPA1ATMTP53 | |
| SCHEMBL29155389 | 0.79 | ESR1 (0.54) | ESR1ESR2KEAP1ABATSCN8A | |
| Ammonia Solution, Strong SCHEMBL27502158 | 0.79 | CALM1 (0.46) | ESR1ESR2 | |
| SCHEMBL10495880 | 0.79 | KEAP1 (0.65) | ESR1ESR2KEAP1ABATMAPT | |
| SCHEMBL11740939 | 0.78 | LTA4H (0.40) | ESR1ESR2MAPK1ALOX5 | |
| SCHEMBL8656644 | 0.78 | KEAP1 (0.78) | ESR1ESR2KEAP1ABATMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107118127-B | Amino-acid schiff base and its synthetic method and application | 哈尔滨理工大学 | 2019-01-04 | — | — | CN | disclosed |
| CN-107118127-A | Amino-acid schiff base and its synthetic method and application | 哈尔滨理工大学 | 2017-09-01 | — | — | CN | disclosed |
| US-6365634-B1 | CUMYLPHENOL; NONSTEROIDAL ANTIINFLAMMATORY AGENT; FROM PEAT BOG | C-P TECHNOLOGY LIMITED PARTNERSHIP | 2002-04-02 | — | — | US | disclosed |
| US-4071565-A | SUBSTITUTED PHENOLS | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1978-01-31 | — | — | US | disclosed |
| US-3989665-A | Butylated, α-methyl styrenated phenolic antioxidants for polymers | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1976-11-02 | — | — | US | disclosed |