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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.45 |
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 SCHEMBL1717 | 0.93 | HTT (0.57) | CYP3A4HTTSMN1; SMN2ALDH1A1KMT2A | |
| Nitric Acid SCHEMBL30496141 | 0.93 | HTT (0.57) | CYP3A4HTTSMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL30078131 | 0.91 | HTT (0.59) | CYP3A4TSHRHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL1583292 | 0.91 | HTT (0.59) | CYP3A4TSHRHTTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2930759 | 0.89 | HTT (0.58) | HTTSMN1; SMN2ALDH1A1KMT2AHPGD | |
| Guanidine SCHEMBL1644175 | 0.86 | CYP3A4 (0.77) | CYP3A4TSHRHTTALDH1A1KMT2A | |
| Sulfuric Acid SCHEMBL21799346 | 0.85 | ALDH1A1 (0.57) | HTTSMN1; SMN2ALDH1A1KMT2AHPGD | |
| Nitric Acid SCHEMBL3858360 | 0.82 | GRIN2D (0.60) | CYP3A4HTTSMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL4107531 | 0.80 | HTT (0.54) | CYP3A4HTTSMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL11876436 | 0.79 | GRIN2D (0.63) | CYP3A4TSHRHTTSMN1; SMN2ALDH1A1 |
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-2146978-A1 | IMATINIB PRODUCTION PROCESS | Chemagis Ltd. (IL) | 2010-01-27 | — | — | EP | disclosed |
| WO-2008135980-A1 | IMATINIB PRODUCTION PROCESS | CHEMAGIS LTD. (IL) | 2008-11-13 | — | — | WO | disclosed |