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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | SLC6A12 | P48065 | 3/20 | 0.34 |
| ▸ | SLC6A11 | P48066 | 3/20 | 0.34 |
| ▸ | SLC6A13 | Q9NSD5 | 3/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.32 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 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 | |
|---|---|---|---|---|
| SCHEMBL114053 | 0.94 | AKR1C4 (0.41) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Bromide SCHEMBL3200051 | 0.92 | AKR1C4 (0.40) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Dimethylamine SCHEMBL15571711 | 0.89 | AKR1C4 (0.38) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Ethylamine SCHEMBL15638660 | 0.88 | AKR1C4 (0.40) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Thiosulfuric Acid SCHEMBL8405542 | 0.87 | AKR1C4 (0.32) | AKR1C4AKR1C3AKR1C2 | |
| Monoethanolamine SCHEMBL15636082 | 0.85 | AKR1C4 (0.36) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Trolamine SCHEMBL19279626 | 0.83 | AKR1C4 (0.37) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| Spermidine SCHEMBL8401062 | 0.82 | PAOX (0.38) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL1614931 | 0.81 | AKR1C4 (0.33) | AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL2584513 | 0.80 | NOS1 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9040096-B2 | Jasmonic acid compounds in cocoa products | THE HERSHEY COMPANY (US) | 2015-05-26 | — | — | US | disclosed |
| US-20110257263-A1 | JASMONIC ACID COMPOUNDS IN COCOA PRODUCTS | THE HERSHEY COMPANY | 2011-10-20 | — | — | US | disclosed |
| WO-2010025209-A1 | JASMONIC ACID COMPOUNDS IN COCOA PRODUCTS | THE HERSHEY COMPANY (US) | 2010-03-04 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20110257263-A1 | JASMONIC ACID COMPOUNDS IN COCOA PRODUCTS | ALOX12, ALOX15, ALOX15B | AKR1C4 562/4885AKR1C3 615/4885AKR1C2 678/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.