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 | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 8/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL45337 | 0.91 | MAPT (0.47) | CA9MAPTALDH1A1CA2CA12 | |
| Benzene SCHEMBL6151758 | 0.89 | MAPT (0.47) | CA9MAPTALDH1A1CA2CA12 | |
| SCHEMBL10670389 | 0.78 | KDM4E (0.41) | CA9MAPTALDH1A1CA2CA12 | |
| SCHEMBL11684797 | 0.76 | CA9 (0.42) | CA9ALDH1A1CA2CA12CA1 | |
| Sulfuric Acid SCHEMBL5843676 | 0.73 | HDAC3 (0.44) | MAPTALDH1A1HDAC1HDAC3HDAC2 | |
| Nitroanilide SCHEMBL6868720 | 0.73 | CA2 (0.44) | CA9MAPTALDH1A1CA2CA12 | |
| 2-Nitroaniline SCHEMBL6868718 | 0.72 | PDE7A (0.53) | MAPTALDH1A1CA2CA1MAPK1 | |
| Nitroanilide SCHEMBL28474437 | 0.72 | CA2 (0.43) | CA9MAPTALDH1A1CA2CA12 | |
| SCHEMBL9390345 | 0.71 | S100A4 (0.42) | CA9MAPTCA2CA12CA1 | |
| SCHEMBL10695718 | 0.71 | HDAC3 (0.46) | CA9MAPTALDH1A1CA2CA12 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103517703-B | Stain and application thereof | 天野酶制品株式会社 | 2016-11-09 | — | — | CN | disclosed |
| CN-103998016-B | Employ the dyeing of the keratin fiber of indole analog | AMANO ENZYME INC. (JP) | 2015-09-16 | — | — | CN | disclosed |
| CN-103998016-A | Dye for keratin fibers using indole analogue | AMANO ENZYME INC | 2014-08-20 | — | — | CN | disclosed |
| CN-103517703-A | Dyeing agent and use for same | AMANO ENZYME INC | 2014-01-15 | — | — | CN | disclosed |
| EP-1082099-A1 | SURFACTANT FOR USE IN EXTERNAL PREPARATIONS FOR SKIN AND EXTERNAL PREPARATION FOR SKIN CONTAINING THE SAME | Showa Denko K K (JP) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999062482-A1 | SURFACTANT FOR USE IN EXTERNAL PREPARATIONS FOR SKIN AND EXTERNAL PREPARATION FOR SKIN CONTAINING THE SAME | SHOWA DENKO K.K. (JP) | 1999-12-09 | — | — | WO | disclosed |
| CN-1052043-A | 2-PART HAIR DYEING AGENTS | SUNSTAR KK (JP) | 1991-06-12 | — | — | CN | disclosed |