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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | RECQL | P46063 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NT5E | P21589 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL111094 | 0.91 | THRB (0.36) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| SCHEMBL29358097 | 0.91 | THRB (0.36) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| Hydrochloric Acid SCHEMBL19549198 | 0.89 | MAPT (0.39) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| SCHEMBL6946033 | 0.89 | THRB (0.35) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| Sulfuric Acid SCHEMBL10790443 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| Sulfuric Acid SCHEMBL2987321 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| Sulfuric Acid SCHEMBL4410003 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| SCHEMBL5181377 | 0.77 | PYGL (0.39) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| SCHEMBL109440 | 0.76 | CYP3A4 (0.43) | ALDH1A1TSHRRECQLCYP3A4THRB | |
| SCHEMBL19972208 | 0.76 | THRB (0.34) | ALDH1A1TSHRRECQLCYP3A4THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999203-B1 | Novel developer in oxidative hair dyeing | CLAIROL INC (US) | 2003-02-26 | — | — | EP | disclosed |
| US-6228130-B1 | 1-(2,5-DIAMINOPHENYL)ETHYLENE GLYCOL; WATER SOLUBLE; P-PHENYLENEDIAMINE REPLACEMENT | BRISTOL-MYERS SQUIBB COMPANY | 2001-05-08 | — | — | US | disclosed |
| EP-0999203-A1 | Novel developer in oxidative hair dyeing | Bristol-Myers Squibb Company (US) | 2000-05-10 | — | — | EP | disclosed |