Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Nitric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL8754524 | 0.80 | CA5A (0.47) | — | |
| Diethanolamine SCHEMBL9901053 | 0.80 | CA5A (0.47) | — | |
| SCHEMBL590441 | 0.78 | — | — | |
| Nitric Acid SCHEMBL2183961 | 0.76 | — | — | |
| Nitric Acid SCHEMBL10491893 | 0.76 | CA5A (0.42) | — | |
| Nitric Acid SCHEMBL7924910 | 0.76 | CA5A (0.42) | — | |
| Diethanolamine SCHEMBL28193120 | 0.76 | CA5A (0.42) | — | |
| Nitric Acid SCHEMBL8193567 | 0.76 | — | — | |
| Nitric Acid SCHEMBL7924915 | 0.76 | CA5A (0.42) | — | |
| Nitric Acid SCHEMBL1832200 | 0.76 | — | — |
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-102432987-B | Antistatic polycarbonate composite material, and preparation method thereof | GUIZHOU ENGINEERING RES CT FOR MODIFIED POLYMER MATERIAL | 2013-06-05 | — | — | CN | claimed |