Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9716243

[Cl-].[O-][S+](CCOCC[n+]1ccccc1)CC(COCCCCCCCCCCCCC1CCCCC1)Oc1ncccn1

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

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 1)

geneUniProtsupporting neighboursconfidence
PTAFR known ✓ P25105 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL9716338 0.87
Hydrochloric Acid SCHEMBL9716349 0.86 KMT2A (0.36) PTAFR
Hydrochloric Acid SCHEMBL9716371 0.85 KMT2A (0.34) PTAFR
SCHEMBL9716400 0.82
Hydrochloric Acid SCHEMBL9716418 0.78 KMT2A (0.35) PTAFR
Hydrochloric Acid SCHEMBL9716365 0.77 FDPS (0.31)
Hydrochloric Acid SCHEMBL9716259 0.77 KDM4A (0.33)
Hydrochloric Acid SCHEMBL9716374 0.76 GMNN (0.34) PTAFR
Hydrochloric Acid SCHEMBL9716386 0.76 HTT (0.43)
Hydrochloric Acid SCHEMBL10552441 0.75 PTAFR (0.41) PTAFR

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5103007-A Antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-04-07 US disclosed