Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | APAF1 | O14727 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 18/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL357535 | 0.99 | MEN1 (0.46) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL357695 | 0.90 | MEN1 (0.44) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL5517313 | 0.88 | MEN1 (0.42) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL357140 | 0.86 | MEN1 (0.51) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL358056 | 0.84 | MEN1 (0.49) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| Trifluoromethanesulfonic Acid SCHEMBL29390371 | 0.82 | MEN1 (0.58) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| Trifluoromethanesulfonic Acid SCHEMBL294105 | 0.82 | MEN1 (0.58) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL1735067 | 0.81 | MEN1 (0.59) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL1736110 | 0.81 | MEN1 (0.59) | MEN1APAF1NPC1PLA2G1BHSP90AA1 | |
| SCHEMBL1735957 | 0.81 | MEN1 (0.59) | MEN1APAF1NPC1PLA2G1BHSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010065606-A2 | PROCESS FOR FERMENTIVE PREPARATION OF ALCOHOLS AND RECOVERY OF PRODUCT | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-06-10 | — | — | WO | disclosed |