Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Nitrous Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Nitrous Acid SCHEMBL9117091 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ALOX15TDP1CA1CA2 | |
| Nitrous Acid SCHEMBL17287222 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ALOX15TDP1CA1CA2 | |
| Nitrous Acid SCHEMBL1902575 | 0.95 | — | — | |
| Nitrous Acid SCHEMBL17287227 | 0.95 | ALDH1A1 (0.70) | ALDH1A1ALOX15TDP1CA1CA2 | |
| Nitrous Acid SCHEMBL29363931 | 0.95 | — | — | |
| Nitrous Acid SCHEMBL29096599 | 0.91 | ALDH1A1 (0.64) | ALDH1A1ALOX15TDP1CA1CA2 | |
| Nitrous Acid SCHEMBL28196689 | 0.86 | — | — | |
| Nitrous Acid SCHEMBL11704834 | 0.85 | — | — | |
| Nitrous Acid SCHEMBL715659 | 0.82 | CA1 (0.55) | ALDH1A1ALOX15TDP1CA1CA2 | |
| Nitrous Acid SCHEMBL16649838 | 0.82 | CA1 (0.55) | ALDH1A1ALOX15TDP1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9708946-B2 | Diesel particulate filter and exhaust gas purification device | MITSUI MINING & SMELTING CO., LTD. (JP) | 2017-07-18 | — | — | US | disclosed |
| US-20160115835-A1 | DIESEL PARTICULATE FILTER AND EXHAUST GAS PURIFICATION DEVICE | MITSUI MINING & SMELTING CO., LTD. (JP) | 2016-04-28 | — | — | US | disclosed |