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 | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | FABP4 | P15090 | 1/20 | 0.30 |
| ▸ | CYP26A1 | O43174 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27735849 | 0.99 | CYP17A1 (0.33) | CYP17A1KDM4EKMT2AALDH1A1MAPT | |
| Sulfuric Acid SCHEMBL28883957 | 0.80 | CYP17A1 (0.38) | CYP17A1KDM4ELMNA | |
| Bromide SCHEMBL28309476 | 0.77 | CYP17A1 (0.42) | CYP17A1KDM4ECYP26A1 | |
| SCHEMBL28348345 | 0.75 | CYP17A1 (0.35) | CYP17A1LMNA | |
| Hydrochloric Acid SCHEMBL19405989 | 0.74 | CYP17A1 (0.34) | CYP17A1LMNA | |
| SCHEMBL27677508 | 0.72 | CYP17A1 (0.41) | CYP17A1 | |
| SCHEMBL11601811 | 0.72 | CYP17A1 (0.41) | CYP17A1KDM4EKMT2AALDH1A1MAPT | |
| Sulfuric Acid SCHEMBL28771647 | 0.71 | CYP19A1 (0.40) | CYP17A1KDM4EKMT2AHTTFABP4 | |
| Sulfuric Acid SCHEMBL28771651 | 0.71 | CYP19A1 (0.40) | CYP17A1KDM4EKMT2AHTTFABP4 | |
| SCHEMBL27657529 | 0.71 | CYP17A1 (0.38) | CYP17A1KDM4ECYP26A1 |
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-101397273-A | 1-vinyl-3-sulfobutyl imidazole bisulfate and preparation method thereof | UNIV HEBEI TECHNOLOGY (CN) | 2009-04-01 | — | — | CN | claimed |