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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN4 | Q9Y3Q4 | 7/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CCL2 | P13500 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL2594562 | 1.00 | HCN4 (0.57) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL31280 | 0.94 | HCN4 (0.64) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL333491 | 0.94 | HCN4 (0.64) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL15858419 | 0.94 | HCN4 (0.64) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL30284992 | 0.94 | HCN4 (0.64) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| Hydrochloric Acid SCHEMBL14696912 | 0.93 | HCN4 (0.63) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| Oxalic Acid SCHEMBL2594323 | 0.91 | HCN4 (0.59) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| Oxalic Acid SCHEMBL2594327 | 0.91 | HCN4 (0.59) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL10022907 | 0.89 | HCN4 (0.58) | HCN4CHRM2HTR1ASLC6A4DRD3 | |
| SCHEMBL16203194 | 0.89 | HCN4 (0.60) | HCN4CHRM2HTR1ASLC6A4DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2566850-A1 | INDUSTRIAL PROCESS FOR THE SYNTHESIS OF IVABRADINE SALTS | Richter Gedeon Nyrt. (HU) | 2013-03-13 | — | — | EP | claimed |
| WO-2011138625-A1 | INDUSTRIAL PROCESS FOR THE SYNTHESIS OF IVABRADINE SALTS | RICHTER GEDEON NYRT. (HU) | 2011-11-10 | — | — | WO | claimed |