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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
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 SCHEMBL27937252 | 0.97 | CA12 (0.37) | CA12CA1CA2CA4NLRP3 | |
| SCHEMBL11495876 | 0.78 | ALDH1A1 (0.43) | CA12CA1CA2CA4MCL1 | |
| Formaldehyde SCHEMBL28154486 | 0.76 | — | — | |
| SCHEMBL11413068 | 0.75 | CA12 (0.40) | CA12CA1CA2CA4NLRP3 | |
| Hydrochloric Acid SCHEMBL28255669 | 0.75 | — | — | |
| Acetic Acid SCHEMBL3939078 | 0.74 | FFAR3 (0.41) | MCL1 | |
| Sulfuric Acid SCHEMBL17023852 | 0.73 | ALDH1A1 (0.60) | NLRP3MCL1CA5ACA5B | |
| Acetaldehyde SCHEMBL27720571 | 0.73 | TSHR (0.40) | CA12CA1CA2CA4MCL1 | |
| Sulfuric Acid SCHEMBL27688300 | 0.73 | — | — | |
| SCHEMBL22769324 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105001121-B | The resource utilization method and device of iminodiacetonitrile production mother liquor | 重庆紫光化工股份有限公司 | 2017-09-22 | — | — | CN | disclosed |
| CN-105017074-A | Iminodiacetonitrile production mother liquor treatment recovery method and apparatus thereof | CHONGQING UNISPLENDOUR CHEM CO | 2015-11-04 | — | — | CN | disclosed |