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 | |
|---|---|---|---|---|
| ▸ | MAOA known ✓ | P21397 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | PGAM1 | P18669 | 8/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL471846 | 0.93 | MAOA (0.52) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL31457155 | 0.93 | MAOA (0.52) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL25370680 | 0.76 | KDM4E (0.61) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL3062866 | 0.76 | KDM4E (0.51) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL31408194 | 0.74 | MAOA (0.62) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL4430606 | 0.74 | MAOA (0.62) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL7797188 | 0.74 | CA12 (0.48) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL8497467 | 0.72 | MAOA (0.52) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL7963729 | 0.72 | NQO1 (0.50) | MAOAMEN1CYP3A4MAPTKMT2A | |
| SCHEMBL11479865 | 0.72 | CYP3A4 (0.58) | MAOAMEN1CYP3A4MAPTKMT2A |
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-1763520-B1 | USE OF TRISUBSTITUTED BENZOPYRANONES | SCHWABE WILLMAR GMBH & CO (DE) | 2008-12-17 | — | — | EP | disclosed |
| EP-1763520-A2 | USE OF TRISUBSTITUTED BENZOPYRANONES | Dr. Willmar Schwabe GmbH & Co. KG (DE) | 2007-03-21 | — | — | EP | disclosed |
| WO-2006002918-A2 | USE OF TRISUBSTITUTED BENZOPYRANONES | DR. WILLMAR SCHWABE GMBH & CO. KG (DE) | 2006-01-12 | — | — | WO | disclosed |