Hydrochloric Acid

Hydrochloric Acid

SCHEMBL31307330

C=Cc1cc[n+](-c2cc(O)ccc2O)cc1.[Cl-]

nearest known ligand 0.38

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 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.38
▸ TRPA1 O75762 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ LCK P06239 1/20 0.32
▸ NQO2 P16083 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ POLB P06746 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
Hydrochloric Acid SCHEMBL31307329 1.00 HDAC8 (0.38) HDAC8TRPA1ALDH1A1LCKNQO2
Hydrochloric Acid SCHEMBL31307327 0.80 GUSB (0.45) TRPA1ALDH1A1LCKNQO2MEN1
Hydrochloric Acid SCHEMBL8640344 0.80 ALOX5 (0.40) ALDH1A1LMNAALOX15HSD17B10TTR
Hydrochloric Acid SCHEMBL31307333 0.77 ACHE (0.39) TRPA1ALDH1A1LMNATP53ALOX15
Hydrochloric Acid SCHEMBL454032 0.76 CA12 (0.38) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL31307331 0.74 CA12 (0.39) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL458456 0.74 CA12 (0.39) ALDH1A1MEN1KMT2APOLBMAPT
Bromide SCHEMBL454874 0.72 CA12 (0.38) ALDH1A1MEN1KMT2APOLBMAPT
Sulfuric Acid SCHEMBL457707 0.68 PTGS1 (0.43) ALDH1A1KMT2AKDM4EPOLBMAPT
SCHEMBL10970999 0.66 PELI1 (0.54) TRPA1ALDH1A1LCKNQO2MEN1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024223200-A1 SWITCHABLE ADSORPTION MATERIALS BASED ON PUNICINES AND YLIDES FOR SELECTIVE SEPARATION AND RECYCLING OF METAL CATIONS AND METAL-CONTAINING ANIONS FROM COMPLEX SOLUTIONS Technische Universität Clausthal (DE) 2024-10-31 — — WO disclosed
EP-4454748-A1 SWITCHABLE ADSORPTION MATERIALS BASED ON PUNICINES AND YLIDES FOR SELECTIVE SEPARATION AND RECYCLING OF METAL CATIONS AND METAL-CONTAINING ANIONS FROM COMPLEX SOLUTIONS Technische Universität Clausthal (DE) 2024-10-30 — — EP disclosed
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