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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL209495 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL28503994 | 0.83 | RAB9A (0.38) | RAB9ACYP1A2TDP1ALDH1A1MEN1 | |
| Sulfuric Acid SCHEMBL8471322 | 0.80 | CYP1A2 (0.48) | CYP1A2TDP1CA5ACA5BL3MBTL1 | |
| Sulfuric Acid SCHEMBL28229391 | 0.80 | CA5A (0.50) | TDP1CA5ACA5BALDH1A1MEN1 | |
| SCHEMBL8325180 | 0.76 | RAB9A (0.34) | RAB9AMEN1KMT2A | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL21616460 | 0.75 | CA5A (0.38) | RAB9ACYP1A2TDP1CA5ACA5B | |
| SCHEMBL12243171 | 0.75 | — | — | |
| SCHEMBL4111804 | 0.74 | APEX1 (0.39) | RAB9AAPEX1KDM4E | |
| N-Methylpiperidine SCHEMBL21616470 | 0.72 | CA1 (0.39) | CYP1A2TDP1CA5ACA5BALDH1A1 | |
| N-Methylpiperidine SCHEMBL28248315 | 0.72 | CA1 (0.39) | CYP1A2TDP1CA5ACA5BALDH1A1 |
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-112142698-A | Method for degrading N-acetylglucosamine by novel sulfonyl-containing green ionic liquid to generate 3-acetamido-5-acetylfuran | 天津工业大学 | 2020-12-29 | — | — | CN | disclosed |