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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 4/20 | 0.45 |
| ▸ | ADRB1 known ✓ | P08588 | 2/20 | 0.45 |
| ▸ | ADRB3 known ✓ | P13945 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7736874 | 0.93 | TSHR (0.60) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL8844964 | 0.81 | TSHR (0.64) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| Sulfuric Acid SCHEMBL11482267 | 0.80 | PNLIP (0.47) | TSHRMAPK1CYP3A4ADRB2MMP1 | |
| SCHEMBL9585313 | 0.76 | TSHR (0.57) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL26638222 | 0.76 | ADRB2 (0.62) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL4683471 | 0.76 | PARP15 (0.55) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL4683466 | 0.76 | PARP15 (0.55) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL4689656 | 0.75 | TSHR (0.56) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| SCHEMBL4683475 | 0.75 | TSHR (0.56) | TSHRMAPK1AGTR1LMNACYP1A2 | |
| Sulfuric Acid SCHEMBL31254117 | 0.74 | TSHR (0.85) | TSHRCYP3A4MMP1NFKB1BLM |
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-111595987-A | Metabolic marker related to pulmonary hypertension in heart failure progression process and application | 深圳大学 | 2020-08-28 | — | — | CN | disclosed |