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.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL37468 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL2754173 | 0.83 | — | — | |
| Bicarbonate SCHEMBL28513279 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRMAPTSMN1; SMN2KMT2A | |
| Sulfuric Acid SCHEMBL5198700 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TSHRMAPTSMN1; SMN2KMT2A | |
| SCHEMBL28826948 | 0.77 | TSHR (0.48) | ALDH1A1TSHRMAPTSMN1; SMN2KMT2A | |
| Nitric Acid SCHEMBL5498006 | 0.76 | CA5A (0.40) | TSHRSMN1; SMN2KMT2ACA5ACA5B | |
| Nitric Acid SCHEMBL726259 | 0.74 | — | — | |
| Nitric Acid SCHEMBL11148323 | 0.73 | CA5A (0.42) | ALDH1A1TSHRMAPTSMN1; SMN2KMT2A | |
| SCHEMBL3164772 | 0.72 | MAPT (0.36) | ALDH1A1TSHRMAPTSMN1; SMN2KMT2A | |
| Nitric Acid SCHEMBL7160358 | 0.72 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111978262-A | Synthetic method of hydroxypyrimidine compound | 西安近代化学研究所 | 2020-11-24 | — | — | CN | claimed |
| CN-1119327-C | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2003-08-27 | — | — | CN | claimed |
| EP-0971886-B1 | METHOD FOR PRODUCING N-ALKYL-N'-NITROGUANIDINES | BAYER CROPSCIENCE AG (DE) | 2003-01-15 | — | — | EP | claimed |
| US-6114581-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-05 | — | — | US | claimed |
| CN-1251089-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2000-04-19 | — | — | CN | claimed |
| CN-111978262-A | Synthetic method of hydroxypyrimidine compound | 西安近代化学研究所 | 2020-11-24 | — | — | CN | disclosed |
| CN-1119327-C | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2003-08-27 | — | — | CN | disclosed |
| CN-1119327-C | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2003-08-27 | — | — | CN | disclosed |
| EP-0971886-B1 | METHOD FOR PRODUCING N-ALKYL-N'-NITROGUANIDINES | BAYER CROPSCIENCE AG (DE) | 2003-01-15 | — | — | EP | disclosed |
| EP-1218362-A1 | METHOD FOR PRODUCING 3-ALKYL-N-NITRO-4H-1,3,5-OXADIAZINE-4-IMINES | NIGU CHEMIE GMBH (DE) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001025222-A1 | METHOD FOR PRODUCING 3-ALKYL-N-NITRO-4H-1,3,5-OXADIAZINE-4-IMINES | NIGU CHEMIE GMBH (DE) | 2001-04-12 | — | — | WO | disclosed |
| US-6114581-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-05 | — | — | US | disclosed |
| US-6114581-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-05 | — | — | US | disclosed |
| CN-1251089-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2000-04-19 | — | — | CN | disclosed |
| CN-1251089-A | Method for producing N-alkyl-N'-nitroguanidines | BAYER AG (DE) | 2000-04-19 | — | — | CN | disclosed |
| EP-0971886-A1 | METHOD FOR PRODUCING N-ALKYL-N'-NITROGUANIDINES | BAYER AG (DE) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998043951-A1 | METHOD FOR PRODUCING N-ALKYL-N'-NITROGUANIDINES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-10-08 | — | — | WO | disclosed |