Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7758128

CN(C)c1cccc[n+]1Cc1ccccc1.[Cl-]

nearest known ligand 0.49

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 19)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.39
CHKA P35790 7/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 4/20 0.49
HTT P42858 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 3/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
MITF O75030 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL7858178 0.86 CHKA (0.44) CHKAALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL7851786 0.84 ACHE (0.46) CHKAALDH1A1LMNAHTTCYP2D6
Hydrochloric Acid SCHEMBL7861856 0.80 MEN1 (0.59) ALDH1A1LMNASMN1; SMN2CYP2C19KDM4E
Bromide SCHEMBL7857771 0.77 MEN1 (0.56) ALDH1A1LMNAHTTSMN1; SMN2CYP2C19
Hydrochloric Acid SCHEMBL637319 0.75 RAB9A (0.52) CHKAALDH1A1LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL29754142 0.75 RAB9A (0.52) CHKAALDH1A1LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL31429413 0.74 NPC1 (0.36) CHKAALDH1A1LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL9347095 0.73 KDM4A (0.46) ALDH1A1LMNAHTTSMN1; SMN2CYP2D6
SCHEMBL2469671 0.72 RAB9A (0.53) CHKAALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL29519716 0.72 RAB9A (0.53) CHKAALDH1A1LMNAHTTSMN1; SMN2

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-2001085825-A2 METHOD OF POLYCARBONATE PREPARATION GENERAL ELECTRIC COMPANY (US) 2001-11-15 WO disclosed
US-6204386-B1 PYRIDINIUM COMPOUND ARTEVA NORTH AMERICA S.A.R.L. (CH) 2001-03-20 US disclosed