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 | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 4/20 | 0.76 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.76 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MERTK | Q12866 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 3/20 | 0.31 |
| ▸ | CCR2 | P41597 | 2/20 | 0.30 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.30 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.30 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.30 |
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 SCHEMBL28455727 | 0.98 | CRBN (0.73) | CRBNFKBP5OR51E2KDM4EGAA | |
| Caprolactam SCHEMBL1521129 | 0.98 | CRBN (0.73) | CRBNFKBP5OR51E2KDM4EGAA | |
| Caprolactam SCHEMBL27823099 | 0.96 | CRBN (0.70) | CRBNFKBP5OR51E2KDM4EGAA | |
| Caprolactam SCHEMBL27970597 | 0.96 | CRBN (0.70) | CRBNFKBP5OR51E2KDM4EGAA | |
| Caprolactam SCHEMBL27842057 | 0.94 | CRBN (0.67) | CRBNFKBP5OR51E2KDM4EGAA | |
| 2-Pyrrolidone SCHEMBL27698786 | 0.93 | OR51E2 (0.75) | CRBNFKBP5OR51E2KDM4EGAA | |
| 2-Pyrrolidone SCHEMBL17061486 | 0.93 | OR51E2 (0.75) | CRBNFKBP5OR51E2KDM4EGAA | |
| 2-Pyrrolidone SCHEMBL4966601 | 0.91 | OR51E2 (0.71) | CRBNFKBP5OR51E2KDM4EGAA | |
| Caprolactam SCHEMBL28831685 | 0.89 | CRBN (0.67) | CRBNFKBP5OR51E2KDM4EGAA | |
| SCHEMBL5542 | 0.87 | — | — |
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-118002140-A | Transition metal tungstate catalyst and method for synthesizing valerolactam by using same | 河南省生物基材料产业研究院有限公司 | 2024-05-10 | — | — | CN | disclosed |
| CN-116003303-A | Synthesis method of valerolactam | 中国石油化工股份有限公司 | 2023-04-25 | — | — | CN | disclosed |