Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.45 |
| ▸ | KHK | P50053 | 1/20 | 0.38 |
| ▸ | USP8 | P40818 | 1/20 | 0.36 |
| ▸ | USP7 | Q93009 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL28577787 | 1.00 | TRPV4 (0.45) | TRPV4KHKUSP8USP7KAT6A | |
| SCHEMBL2783854 | 0.84 | TRPV4 (0.56) | TRPV4KHKUSP8USP7CYP11B2 | |
| SCHEMBL366972 | 0.74 | TRPV4 (0.65) | TRPV4KHKCYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL15492097 | 0.73 | USP8 (0.38) | USP8USP7SLC22A12MEN1KMT2A | |
| SCHEMBL1128865 | 0.73 | TRPV4 (0.46) | TRPV4KHKESR1ESR2 | |
| SCHEMBL20444104 | 0.72 | TRPV4 (0.50) | TRPV4KHKCYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL14316191 | 0.72 | TRPV4 (0.44) | TRPV4KHKCYP11B2CYP11B1ESR1 | |
| SCHEMBL21505592 | 0.70 | TRPV4 (0.43) | TRPV4KHKCYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL23730336 | 0.68 | TRPV4 (0.46) | TRPV4KHKCYP11B2CYP11B1MEN1 | |
| SCHEMBL404483 | 0.68 | KHK (0.48) | TRPV4KHKCYP11B2CYP11B1MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112707807-B | Preparation method of 4, 5-difluorophthalic acid | 苏州当量生物医药有限公司 | 2022-06-07 | — | — | CN | claimed |
| CN-112707807-A | Preparation method of 4, 5-difluorophthalic acid | 苏州金蚕新材料科技有限公司 | 2021-04-27 | — | — | CN | claimed |
| CN-112707807-B | Preparation method of 4, 5-difluorophthalic acid | 苏州当量生物医药有限公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-112707807-A | Preparation method of 4, 5-difluorophthalic acid | 苏州金蚕新材料科技有限公司 | 2021-04-27 | — | — | CN | disclosed |