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 | |
|---|---|---|---|---|
| ▸ | TUBB4A known ✓ | P04350 | 1/20 | 0.44 |
| ▸ | TUBB known ✓ | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C known ✓ | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B known ✓ | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A known ✓ | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B known ✓ | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 known ✓ | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A known ✓ | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 known ✓ | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E known ✓ | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A known ✓ | Q71U36 | 1/20 | 0.44 |
| ▸ | TUBA1C known ✓ | Q9BQE3 | 1/20 | 0.44 |
| ▸ | TUBB6 known ✓ | Q9BUF5 | 1/20 | 0.44 |
| ▸ | TUBB2B known ✓ | Q9BVA1 | 1/20 | 0.44 |
| ▸ | TUBB1 known ✓ | Q9H4B7 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
| ▸ | MMP2 | P08253 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29689196 | 0.89 | ALDH1A1 (0.59) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL111151 | 0.89 | ALDH1A1 (0.59) | CA1CA2MMP1MMP2MMP9 | |
| Sulfuric Acid SCHEMBL29558209 | 0.81 | CA1 (0.56) | CA1CA2MMP1MMP2MMP9 | |
| Sulfuric Acid SCHEMBL479725 | 0.81 | CA1 (0.56) | CA1CA2MMP1MMP2MMP9 | |
| Maleic Acid SCHEMBL27604424 | 0.81 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1LMNAHTTCYP3A4 | |
| Sulfuric Acid SCHEMBL11435520 | 0.80 | CA1 (0.54) | CA1CA2MMP1MMP2MMP9 | |
| Sulfuric Acid SCHEMBL4824645 | 0.80 | CA1 (0.54) | CA1CA2MMP1MMP2MMP9 | |
| Sulfuric Acid SCHEMBL10957580 | 0.80 | ALDH1A1 (0.78) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL2224169 | 0.78 | CA1 (0.52) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL155353 | 0.76 | CA1 (0.68) | CA1CA2MMP1MMP2MMP9 |
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-107954989-A | The preparation method of efficient selective EGFR mutant inhibitor AZD9291 | 李梦雪 | 2018-04-24 | — | — | CN | claimed |
| CN-107954989-A | The preparation method of efficient selective EGFR mutant inhibitor AZD9291 | 李梦雪 | 2018-04-24 | — | — | CN | disclosed |